2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride

C21H35ClN2O — CID 2921477

IUPAC2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride
SMILESCCCN(CCC)C(C)C(=O)NCC1(c2ccccc2)CCCC1.Cl
InChIInChI=1S/C21H34N2O.ClH/c1-4-15-23(16-5-2)18(3)20(24)22-17-21(13-9-10-14-21)19-11-7-6-8-12-19;/h6-8,11-12,18H,4-5,9-10,13-17H2,1-3H3,(H,22,24);1H
InChIKeyWBDGRCCIHSGSML-UHFFFAOYSA-N
MW366.98 g/mol
LogP4.55
Rot. Bonds9

About 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride

2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride (PubChem CID 2921477) has the molecular formula C21H35ClN2O and a molecular weight of 366.98 g/mol. Its IUPAC name is 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride.

Molecular Properties

Compound Name2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride
PubChem CID2921477
Molecular FormulaC21H35ClN2O
Molecular Weight366.98 g/mol
Exact Mass366.24
IUPAC Name2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride
SMILESCCCN(CCC)C(C)C(=O)NCC1(c2ccccc2)CCCC1.Cl
InChIInChI=1S/C21H34N2O.ClH/c1-4-15-23(16-5-2)18(3)20(24)22-17-21(13-9-10-14-21)19-11-7-6-8-12-19;/h6-8,11-12,18H,4-5,9-10,13-17H2,1-3H3,(H,22,24);1H
InChIKeyWBDGRCCIHSGSML-UHFFFAOYSA-N
XLogP4.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.98
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride?
The IUPAC name of 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride (CID 2921477) is 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride.
What is the SMILES notation for 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride?
The canonical SMILES for 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride is CCCN(CCC)C(C)C(=O)NCC1(c2ccccc2)CCCC1.Cl.
What is the InChIKey of 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride?
The InChIKey is WBDGRCCIHSGSML-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H34N2O.ClH/c1-4-15-23(16-5-2)18(3)20(24)22-17-21(13-9-10-14-21)19-11-7-6-8-12-19;/h6-8,11-12,18H,4-5,9-10,13-17H2,1-3H3,(H,22,24);1H.
What are the key properties of 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride?
2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride has a molecular weight of 366.98 g/mol, XLogP of 4.55, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dipropylamino)-N-[(1-phenylcyclopentyl)methyl]propanamide;hydrochloride is sourced from PubChem (CID 2921477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).