N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide

C17H30N2O — CID 63131593

IUPACN-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide
SMILESC=CCN(C(=O)C1(CCC)CCCNC1)C1CCCC1
InChIInChI=1S/C17H30N2O/c1-3-10-17(11-7-12-18-14-17)16(20)19(13-4-2)15-8-5-6-9-15/h4,15,18H,2-3,5-14H2,1H3
InChIKeyRPWKXTZRLIJRTI-UHFFFAOYSA-N
MW278.44 g/mol
LogP3.11
Rot. Bonds6

About N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide

N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide (PubChem CID 63131593) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide
PubChem CID63131593
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC NameN-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide
SMILESC=CCN(C(=O)C1(CCC)CCCNC1)C1CCCC1
InChIInChI=1S/C17H30N2O/c1-3-10-17(11-7-12-18-14-17)16(20)19(13-4-2)15-8-5-6-9-15/h4,15,18H,2-3,5-14H2,1H3
InChIKeyRPWKXTZRLIJRTI-UHFFFAOYSA-N
XLogP3.11
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopentyl-N-methyl-3-propylpiperidine-3-carboxamide
CID 63130051
N,N-bis(prop-2-enyl)-3-propylpiperidine-3-carboxamide
CID 63132269
1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide
CID 113311622
N-cyclopentyl-3-propan-2-yl-N-prop-2-enylpyrrolidine-3-carboxamide
CID 106980144
N-(cyclopropylmethyl)-N,3-dipropylpiperidine-3-carboxamide
CID 55164307
N-methyl-N-propan-2-yl-3-propylpiperidine-3-carboxamide
CID 63132392
N-methoxy-N-methyl-3-propylpiperidine-3-carboxamide
CID 63135339
N-butyl-N-cyclopropyl-3-ethylpiperidine-3-carboxamide
CID 63131459
N-cycloheptyl-3-ethyl-N-methylpiperidine-3-carboxamide
CID 63130331
N-ethyl-N-(2-hydroxyethyl)-3-propylpiperidine-3-carboxamide
CID 63131140
(4-methylcyclohexyl)-(3-propylpiperidin-3-yl)methanone
CID 116569810
(4-hydroxypiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63132180

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide?
The IUPAC name of N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide (CID 63131593) is N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide is C=CCN(C(=O)C1(CCC)CCCNC1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide?
The InChIKey is RPWKXTZRLIJRTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c1-3-10-17(11-7-12-18-14-17)16(20)19(13-4-2)15-8-5-6-9-15/h4,15,18H,2-3,5-14H2,1H3.
What are the key properties of N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide?
N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide has a molecular weight of 278.44 g/mol, XLogP of 3.11, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-prop-2-enyl-3-propylpiperidine-3-carboxamide is sourced from PubChem (CID 63131593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).