(3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide

C14H26N4O2 — CID 163427134

IUPAC(3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide
SMILESCNC1CCCN([C@H]2CNCC[C@@H]2C(=O)N(C)C)C1=O
InChIInChI=1S/C14H26N4O2/c1-15-11-5-4-8-18(14(11)20)12-9-16-7-6-10(12)13(19)17(2)3/h10-12,15-16H,4-9H2,1-3H3/t10-,11?,12-/m0/s1
InChIKeyANMBAALKGWFQBA-PRWSFJOGSA-N
MW282.39 g/mol
LogP-0.74
Rot. Bonds3

About (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide

(3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide (PubChem CID 163427134) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name(3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide
PubChem CID163427134
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name(3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide
SMILESCNC1CCCN([C@H]2CNCC[C@@H]2C(=O)N(C)C)C1=O
InChIInChI=1S/C14H26N4O2/c1-15-11-5-4-8-18(14(11)20)12-9-16-7-6-10(12)13(19)17(2)3/h10-12,15-16H,4-9H2,1-3H3/t10-,11?,12-/m0/s1
InChIKeyANMBAALKGWFQBA-PRWSFJOGSA-N
XLogP-0.74
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(S)-4-Amino-1-piperidin-1-yl-2-(piperidin-4-ylamino)-butan-1-one
CID 10468265
(S)-2-((S)-4-((S)-2-((S)-3-Isobutyl-2-oxopiperazin-1-yl)-4-methylpentanoyl)-3-methyl-2-oxopiperazin-1-yl)pentanediamide
CID 71664643
3-(2-Butanyl)-6-methyl-2,5-piperazinedione
CID 45359405
(3S,6S)-3-((2S)-butan-2-yl)-6-methylpiperazine-2,5-dione
CID 71359704
(R)-4-((S)-3-amino-4-(2-oxopiperidin-1-yl)butanoyl)-3-methyl-1,4-diazepan-2-one
CID 44561191
1-acetyl-N-(1-propylpiperidin-4-yl)piperidine-4-carboxamide
CID 6467229
(3S,6S)-3-[(2S)-butan-2-yl]-6-propan-2-ylpiperazine-2,5-dione
CID 12086127
3,6-Di-sec-butylpiperazine-2,5-dione
CID 3252652
3-[4-(1-Piperidinylcarbonyl)-1-piperidinyl]-2,5-pyrrolidinedione
CID 2979075
3-[2-(4-Cyclohexyl-3-oxopiperazin-1-yl)-2-oxoethyl]-4-(2-methylpropyl)piperazin-2-one
CID 24791447
2-[[(3S)-1-[(2S)-2-amino-4-methylpentanoyl]piperidin-3-yl]amino]acetamide
CID 57341633
2-[[(3R)-1-[(2S)-2-amino-4-methylpentanoyl]piperidin-3-yl]amino]acetamide
CID 57343683

Frequently Asked Questions

What is the IUPAC name of (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide?
The IUPAC name of (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide (CID 163427134) is (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide.
What is the SMILES notation for (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide?
The canonical SMILES for (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide is CNC1CCCN([C@H]2CNCC[C@@H]2C(=O)N(C)C)C1=O.
What is the InChIKey of (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide?
The InChIKey is ANMBAALKGWFQBA-PRWSFJOGSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-15-11-5-4-8-18(14(11)20)12-9-16-7-6-10(12)13(19)17(2)3/h10-12,15-16H,4-9H2,1-3H3/t10-,11?,12-/m0/s1.
What are the key properties of (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide?
(3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide has a molecular weight of 282.39 g/mol, XLogP of -0.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4S)-N,N-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]piperidine-4-carboxamide is sourced from PubChem (CID 163427134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).