1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide

C19H30N4O — CID 119903462

IUPAC1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide
SMILESCC(CN1CCN(c2ccccc2)CC1)NC(=O)C1(N)CCCC1
InChIInChI=1S/C19H30N4O/c1-16(21-18(24)19(20)9-5-6-10-19)15-22-11-13-23(14-12-22)17-7-3-2-4-8-17/h2-4,7-8,16H,5-6,9-15,20H2,1H3,(H,21,24)
InChIKeyROPIXHNZEQIGPJ-UHFFFAOYSA-N
MW330.48 g/mol
LogP1.58
Rot. Bonds5

About 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide

1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide (PubChem CID 119903462) has the molecular formula C19H30N4O and a molecular weight of 330.48 g/mol. Its IUPAC name is 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide
PubChem CID119903462
Molecular FormulaC19H30N4O
Molecular Weight330.48 g/mol
Exact Mass330.24
IUPAC Name1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide
SMILESCC(CN1CCN(c2ccccc2)CC1)NC(=O)C1(N)CCCC1
InChIInChI=1S/C19H30N4O/c1-16(21-18(24)19(20)9-5-6-10-19)15-22-11-13-23(14-12-22)17-7-3-2-4-8-17/h2-4,7-8,16H,5-6,9-15,20H2,1H3,(H,21,24)
InChIKeyROPIXHNZEQIGPJ-UHFFFAOYSA-N
XLogP1.58
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(methylamino)-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]butanamide
CID 119903454
1-[(2S)-1-hydroxypropan-2-yl]-3-[(2S)-1-(4-phenylpiperazin-1-yl)propan-2-yl]urea
CID 97019834
1-amino-N-methyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]cyclohexane-1-carboxamide
CID 119903422
(2S)-2-methylsulfonyl-N-[(2S)-1-(4-phenylpiperazin-1-yl)propan-2-yl]propanamide
CID 95776431
2-methyl-3-(methylamino)-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]propanamide;trihydrochloride
CID 119903471
1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide
CID 61251912
1-(4-hydroxy-3-methylbutan-2-yl)-3-[1-(4-phenylpiperazin-1-yl)propan-2-yl]urea
CID 111506661
2-chloro-5-hydroxy-N-[(2S)-1-(4-phenylpiperazin-1-yl)propan-2-yl]benzamide
CID 100647066
2-chloro-5-hydroxy-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]benzamide
CID 119035650
N-[(2R)-1-(4-phenylpiperazin-1-yl)propan-2-yl]pent-4-enamide
CID 95776434
1-amino-N-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119870682
1-amino-N-[4-oxo-4-(3-pyrrolidin-1-ylanilino)butan-2-yl]cyclopentane-1-carboxamide;dihydrochloride
CID 119872902

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide (CID 119903462) is 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide is CC(CN1CCN(c2ccccc2)CC1)NC(=O)C1(N)CCCC1.
What is the InChIKey of 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide?
The InChIKey is ROPIXHNZEQIGPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O/c1-16(21-18(24)19(20)9-5-6-10-19)15-22-11-13-23(14-12-22)17-7-3-2-4-8-17/h2-4,7-8,16H,5-6,9-15,20H2,1H3,(H,21,24).
What are the key properties of 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide?
1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide has a molecular weight of 330.48 g/mol, XLogP of 1.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119903462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).