N,N-dipentylpyrrolidine-3-carboxamide

C15H30N2O — CID 63005585

IUPACN,N-dipentylpyrrolidine-3-carboxamide
SMILESCCCCCN(CCCCC)C(=O)C1CCNC1
InChIInChI=1S/C15H30N2O/c1-3-5-7-11-17(12-8-6-4-2)15(18)14-9-10-16-13-14/h14,16H,3-13H2,1-2H3
InChIKeyKHGSEKFWEBAEGD-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.80
Rot. Bonds9

About N,N-dipentylpyrrolidine-3-carboxamide

N,N-dipentylpyrrolidine-3-carboxamide (PubChem CID 63005585) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N,N-dipentylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN,N-dipentylpyrrolidine-3-carboxamide
PubChem CID63005585
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN,N-dipentylpyrrolidine-3-carboxamide
SMILESCCCCCN(CCCCC)C(=O)C1CCNC1
InChIInChI=1S/C15H30N2O/c1-3-5-7-11-17(12-8-6-4-2)15(18)14-9-10-16-13-14/h14,16H,3-13H2,1-2H3
InChIKeyKHGSEKFWEBAEGD-UHFFFAOYSA-N
XLogP2.80
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-dihexylpiperidine-4-carboxamide
CID 60947458
N,N-dibutylpiperidine-3-carboxamide;hydrochloride
CID 119262431
N-[(4-chlorophenyl)methyl]-N-pentylpyrrolidine-3-carboxamide
CID 119688890
N-butyl-N-cyclopropylpyrrolidine-3-carboxamide
CID 63005582
N-[2-(dimethylamino)-2-oxoethyl]-N-propylpyrrolidine-3-carboxamide
CID 63005457
(3S)-N-methyl-N-pentylpiperidine-3-carboxamide
CID 81123765
N,N-dipropylpiperidine-4-carboxamide;hydrochloride
CID 53410679
(2S)-N,N-dipentylpyrrolidine-2-carboxamide
CID 61165096
[2-(dibutylamino)-2-oxoethyl] pyrrolidine-3-carboxylate
CID 70080553
4-amino-N,N-dipentylcyclohexane-1-carboxamide
CID 60947028
N-ethyl-N-prop-2-enylpyrrolidine-3-carboxamide
CID 81490031
(2R)-N,N-dipentylpiperidine-2-carboxamide
CID 93372342

Frequently Asked Questions

What is the IUPAC name of N,N-dipentylpyrrolidine-3-carboxamide?
The IUPAC name of N,N-dipentylpyrrolidine-3-carboxamide (CID 63005585) is N,N-dipentylpyrrolidine-3-carboxamide.
What is the SMILES notation for N,N-dipentylpyrrolidine-3-carboxamide?
The canonical SMILES for N,N-dipentylpyrrolidine-3-carboxamide is CCCCCN(CCCCC)C(=O)C1CCNC1.
What is the InChIKey of N,N-dipentylpyrrolidine-3-carboxamide?
The InChIKey is KHGSEKFWEBAEGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-5-7-11-17(12-8-6-4-2)15(18)14-9-10-16-13-14/h14,16H,3-13H2,1-2H3.
What are the key properties of N,N-dipentylpyrrolidine-3-carboxamide?
N,N-dipentylpyrrolidine-3-carboxamide has a molecular weight of 254.42 g/mol, XLogP of 2.80, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipentylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63005585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).