(3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide

C21H32N4O4 — CID 51954366

IUPAC(3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide
SMILESO=C(NCC1CC1)[C@@H]1CCCN(C(=O)CCN2C(=O)NC3(CCCCC3)C2=O)C1
InChIInChI=1S/C21H32N4O4/c26-17(24-11-4-5-16(14-24)18(27)22-13-15-6-7-15)8-12-25-19(28)21(23-20(25)29)9-2-1-3-10-21/h15-16H,1-14H2,(H,22,27)(H,23,29)/t16-/m1/s1
InChIKeyOVPSVRXASGNKCE-MRXNPFEDSA-N
MW404.51 g/mol
LogP1.40
Rot. Bonds6

About (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide

(3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide (PubChem CID 51954366) has the molecular formula C21H32N4O4 and a molecular weight of 404.51 g/mol. Its IUPAC name is (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide
PubChem CID51954366
Molecular FormulaC21H32N4O4
Molecular Weight404.51 g/mol
Exact Mass404.24
IUPAC Name(3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide
SMILESO=C(NCC1CC1)[C@@H]1CCCN(C(=O)CCN2C(=O)NC3(CCCCC3)C2=O)C1
InChIInChI=1S/C21H32N4O4/c26-17(24-11-4-5-16(14-24)18(27)22-13-15-6-7-15)8-12-25-19(28)21(23-20(25)29)9-2-1-3-10-21/h15-16H,1-14H2,(H,22,27)(H,23,29)/t16-/m1/s1
InChIKeyOVPSVRXASGNKCE-MRXNPFEDSA-N
XLogP1.40
TPSA98.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.51
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[3-[(3R)-3-(methylaminomethyl)piperidin-1-yl]-3-oxopropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 124688347
3-[3-[(3S)-3-(methylaminomethyl)piperidin-1-yl]-3-oxopropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 124686592
3-(3-oxo-3-piperidin-1-ylpropyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 35809666
N-(cyclopropylmethyl)-1-[2-(1-hydroxycyclohexyl)acetyl]piperidine-3-carboxamide
CID 111331904
3-[3-(3-methylpiperazin-1-yl)-3-oxopropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 122147866
3-[4-oxo-4-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]butyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 55441904
(3R)-N-(cyclopropylmethyl)-1-[3-(4-methoxyphenyl)propanoyl]piperidine-3-carboxamide
CID 94202656
N-(cyclopropylmethyl)-1-[2-(methylamino)acetyl]piperidine-3-carboxamide;hydrochloride
CID 119724080
3-[3-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-3-oxopropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 55469761
(3R)-1-[2-(8-tert-butyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetyl]-N-[(2S)-pentan-2-yl]piperidine-3-carboxamide
CID 52518493
3-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 7043462
3-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-4-oxobutyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 97201760

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide (CID 51954366) is (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide is O=C(NCC1CC1)[C@@H]1CCCN(C(=O)CCN2C(=O)NC3(CCCCC3)C2=O)C1.
What is the InChIKey of (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide?
The InChIKey is OVPSVRXASGNKCE-MRXNPFEDSA-N. The full InChI is InChI=1S/C21H32N4O4/c26-17(24-11-4-5-16(14-24)18(27)22-13-15-6-7-15)8-12-25-19(28)21(23-20(25)29)9-2-1-3-10-21/h15-16H,1-14H2,(H,22,27)(H,23,29)/t16-/m1/s1.
What are the key properties of (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide?
(3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide has a molecular weight of 404.51 g/mol, XLogP of 1.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(cyclopropylmethyl)-1-[3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanoyl]piperidine-3-carboxamide is sourced from PubChem (CID 51954366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).