4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide

C16H30N4O — CID 66432440

IUPAC4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide
SMILESNCC(CC(=O)NC1CC1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C16H30N4O/c17-12-15(11-16(21)18-13-5-6-13)20-9-7-19(8-10-20)14-3-1-2-4-14/h13-15H,1-12,17H2,(H,18,21)
InChIKeyIAHWADLYEMLMKV-UHFFFAOYSA-N
MW294.44 g/mol
LogP0.54
Rot. Bonds6

About 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide

4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide (PubChem CID 66432440) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide.

Molecular Properties

Compound Name4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide
PubChem CID66432440
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC Name4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide
SMILESNCC(CC(=O)NC1CC1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C16H30N4O/c17-12-15(11-16(21)18-13-5-6-13)20-9-7-19(8-10-20)14-3-1-2-4-14/h13-15H,1-12,17H2,(H,18,21)
InChIKeyIAHWADLYEMLMKV-UHFFFAOYSA-N
XLogP0.54
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide
CID 66431608
4-amino-N-cyclopropyl-3-(4-propan-2-ylazepan-1-yl)butanamide
CID 66429992
4-amino-N-cyclopropyl-3-(3,4,5-trimethylpiperazin-1-yl)butanamide
CID 114537377
4-amino-N-cyclopropyl-3-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)butanamide
CID 66430397
2-[4-(1-aminobutan-2-yl)piperazin-1-yl]-N-cyclopropylacetamide
CID 63340617
4-amino-3-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-N-tert-butylbutanamide
CID 66431026
2-(4-cyclopentylpiperazin-1-yl)-4,4-dimethylpentan-1-amine
CID 62950972
4-amino-N-(1-cyclopentylpiperidin-4-yl)butanamide;dihydrochloride
CID 119846701
N-(1-cyclohexylpiperidin-4-yl)-2-(methylamino)acetamide
CID 120704864
2-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-N-cyclopropylacetamide
CID 51618982
4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide
CID 66430565
2-(4-cyclopentylpiperazin-1-yl)octan-1-amine
CID 62369576

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide?
The IUPAC name of 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide (CID 66432440) is 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide.
What is the SMILES notation for 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide?
The canonical SMILES for 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide is NCC(CC(=O)NC1CC1)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide?
The InChIKey is IAHWADLYEMLMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c17-12-15(11-16(21)18-13-5-6-13)20-9-7-19(8-10-20)14-3-1-2-4-14/h13-15H,1-12,17H2,(H,18,21).
What are the key properties of 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide?
4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide has a molecular weight of 294.44 g/mol, XLogP of 0.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide is sourced from PubChem (CID 66432440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).