N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide

C10H19N3O2 — CID 106235636

IUPACN-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide
SMILESNC(=O)CCCCNC(=O)C1CCNC1
InChIInChI=1S/C10H19N3O2/c11-9(14)3-1-2-5-13-10(15)8-4-6-12-7-8/h8,12H,1-7H2,(H2,11,14)(H,13,15)
InChIKeyBFDCZPVWLIXEDV-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.63
Rot. Bonds6

About N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide

N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide (PubChem CID 106235636) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide
PubChem CID106235636
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC NameN-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide
SMILESNC(=O)CCCCNC(=O)C1CCNC1
InChIInChI=1S/C10H19N3O2/c11-9(14)3-1-2-5-13-10(15)8-4-6-12-7-8/h8,12H,1-7H2,(H2,11,14)(H,13,15)
InChIKeyBFDCZPVWLIXEDV-UHFFFAOYSA-N
XLogP-0.63
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

7-(pyrrolidine-3-carbonylamino)heptanoic acid
CID 63005734
N-hex-5-ynylpyrrolidine-3-carboxamide
CID 106213094
N-tetradecylpyrrolidine-3-carboxamide;hydrochloride
CID 154586688
(3S)-N-(2-amino-2-oxoethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 130670847
N-(4,4,4-trifluorobutyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119781584
N-(2-fluoroethyl)pyrrolidine-3-carboxamide
CID 76624204
N-[4-(diethylamino)butyl]pyrrolidine-3-carboxamide
CID 119852584
4-amino-N-(5-amino-5-oxopentyl)cyclohexane-1-carboxamide
CID 106235907
N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 87325134
N-[3-(azepan-1-yl)propyl]pyrrolidine-3-carboxamide
CID 119831281
methyl 6-(piperidine-3-carbonylamino)hexanoate
CID 119269488
N-[4-(4-methylpiperidin-1-yl)butyl]pyrrolidine-3-carboxamide
CID 119852455

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide (CID 106235636) is N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide is NC(=O)CCCCNC(=O)C1CCNC1.
What is the InChIKey of N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide?
The InChIKey is BFDCZPVWLIXEDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c11-9(14)3-1-2-5-13-10(15)8-4-6-12-7-8/h8,12H,1-7H2,(H2,11,14)(H,13,15).
What are the key properties of N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide?
N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide has a molecular weight of 213.28 g/mol, XLogP of -0.63, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 106235636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).