1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide

C19H31N3O — CID 119849960

IUPAC1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide
SMILESCCN(CC)C(CNC(=O)C1(N)CCCC1)Cc1ccccc1
InChIInChI=1S/C19H31N3O/c1-3-22(4-2)17(14-16-10-6-5-7-11-16)15-21-18(23)19(20)12-8-9-13-19/h5-7,10-11,17H,3-4,8-9,12-15,20H2,1-2H3,(H,21,23)
InChIKeyDYPDDJQSFJJNBL-UHFFFAOYSA-N
MW317.48 g/mol
LogP2.33
Rot. Bonds8

About 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide

1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide (PubChem CID 119849960) has the molecular formula C19H31N3O and a molecular weight of 317.48 g/mol. Its IUPAC name is 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide
PubChem CID119849960
Molecular FormulaC19H31N3O
Molecular Weight317.48 g/mol
Exact Mass317.25
IUPAC Name1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide
SMILESCCN(CC)C(CNC(=O)C1(N)CCCC1)Cc1ccccc1
InChIInChI=1S/C19H31N3O/c1-3-22(4-2)17(14-16-10-6-5-7-11-16)15-21-18(23)19(20)12-8-9-13-19/h5-7,10-11,17H,3-4,8-9,12-15,20H2,1-2H3,(H,21,23)
InChIKeyDYPDDJQSFJJNBL-UHFFFAOYSA-N
XLogP2.33
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.48
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(2,3-diphenylpropyl)cyclopentane-1-carboxamide
CID 119335236
2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide
CID 119849948
N-[2-(diethylamino)-3-phenylpropyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120642373
2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide
CID 119849944
2-amino-N-[2-(diethylamino)-3-phenylpropyl]benzamide
CID 119946555
1-amino-N-(2-hydroxy-2-phenylethyl)cyclohexane-1-carboxamide
CID 43500059
1-amino-N-[2-(dimethylamino)-2-phenylethyl]cyclohexane-1-carboxamide
CID 61250903
3-amino-N-[2-(diethylamino)-3-phenylpropyl]pyrazine-2-carboxamide
CID 43067611
N-[2-(diethylamino)-3-phenylpropyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
CID 43067463
(2R)-2-[(1-aminocyclopentanecarbonyl)amino]-3-phenylpropanoic acid
CID 103869046
1-amino-N-[2-[benzyl(methyl)amino]-2-oxoethyl]cyclopentane-1-carboxamide
CID 119287101
N-[2-(diethylamino)-3-phenylpropyl]piperidine-2-carboxamide;dihydrochloride
CID 119849955

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide (CID 119849960) is 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide is CCN(CC)C(CNC(=O)C1(N)CCCC1)Cc1ccccc1.
What is the InChIKey of 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide?
The InChIKey is DYPDDJQSFJJNBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O/c1-3-22(4-2)17(14-16-10-6-5-7-11-16)15-21-18(23)19(20)12-8-9-13-19/h5-7,10-11,17H,3-4,8-9,12-15,20H2,1-2H3,(H,21,23).
What are the key properties of 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide?
1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide has a molecular weight of 317.48 g/mol, XLogP of 2.33, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119849960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).