N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide

C13H24N4O2 — CID 59031008

IUPACN-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide
SMILESO=C(NCNC(=O)N1CCCCC1)N1CCCCC1
InChIInChI=1S/C13H24N4O2/c18-12(16-7-3-1-4-8-16)14-11-15-13(19)17-9-5-2-6-10-17/h1-11H2,(H,14,18)(H,15,19)
InChIKeyXECPOVNSPOXZTP-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.33
Rot. Bonds2

About N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide

N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide (PubChem CID 59031008) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide
PubChem CID59031008
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC NameN-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide
SMILESO=C(NCNC(=O)N1CCCCC1)N1CCCCC1
InChIInChI=1S/C13H24N4O2/c18-12(16-7-3-1-4-8-16)14-11-15-13(19)17-9-5-2-6-10-17/h1-11H2,(H,14,18)(H,15,19)
InChIKeyXECPOVNSPOXZTP-UHFFFAOYSA-N
XLogP1.33
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-(azocane-1-carbonylamino)acetic acid
CID 43445649
N-(2-oxopropyl)azepane-1-carboxamide
CID 79152815
N-(2-fluoroethyl)piperidine-1-carboxamide
CID 126973652
N-(2-acetamidoethyl)piperidine-1-carboxamide
CID 115575266
N-(3-hydroxypropyl)piperidine-1-carboxamide
CID 112725647
N-(3-oxo-3-piperidin-1-ylpropyl)pyrrolidine-1-carboxamide
CID 115583806
N-[2-methyl-3-(methylamino)propyl]azepane-1-carboxamide
CID 115302691
N-prop-2-ynylpyrrolidine-1-carboxamide
CID 112722494
N-(3-amino-3-hydroxyiminopropyl)azepane-1-carboxamide
CID 79152311
(2S)-3-(azocane-1-carbonylamino)-2-hydroxypropanoic acid
CID 107838219
3-(azocane-1-carbonylamino)-2-hydroxypropanoic acid
CID 66165088
N-(6-hydroxyhexyl)piperidine-1-carboxamide
CID 103918692

Frequently Asked Questions

What is the IUPAC name of N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide?
The IUPAC name of N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide (CID 59031008) is N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide.
What is the SMILES notation for N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide?
The canonical SMILES for N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide is O=C(NCNC(=O)N1CCCCC1)N1CCCCC1.
What is the InChIKey of N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide?
The InChIKey is XECPOVNSPOXZTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c18-12(16-7-3-1-4-8-16)14-11-15-13(19)17-9-5-2-6-10-17/h1-11H2,(H,14,18)(H,15,19).
What are the key properties of N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide?
N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide has a molecular weight of 268.36 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 59031008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).