N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide

C18H28N2O — CID 43136808

IUPACN-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide
SMILESCC(C)(C(=O)N(CCCN)C1CCCC1)c1ccccc1
InChIInChI=1S/C18H28N2O/c1-18(2,15-9-4-3-5-10-15)17(21)20(14-8-13-19)16-11-6-7-12-16/h3-5,9-10,16H,6-8,11-14,19H2,1-2H3
InChIKeyCROWNFPNXRKNGX-UHFFFAOYSA-N
MW288.43 g/mol
LogP3.08
Rot. Bonds6

About N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide

N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide (PubChem CID 43136808) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide
PubChem CID43136808
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC NameN-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide
SMILESCC(C)(C(=O)N(CCCN)C1CCCC1)c1ccccc1
InChIInChI=1S/C18H28N2O/c1-18(2,15-9-4-3-5-10-15)17(21)20(14-8-13-19)16-11-6-7-12-16/h3-5,9-10,16H,6-8,11-14,19H2,1-2H3
InChIKeyCROWNFPNXRKNGX-UHFFFAOYSA-N
XLogP3.08
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloropropyl)-N-cyclobutyl-2-methyl-2-phenylpropanamide
CID 102871982
N-(3-aminopropyl)-N-cyclohexyl-2,2-dimethylpropanamide
CID 43136880
2-methyl-2-phenyl-N-piperidin-4-yl-N-propylpropanamide
CID 60806254
N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide
CID 43319365
1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea
CID 43319508
N-(3-aminopropyl)-N-cyclobutyl-2-methylbenzamide
CID 102873748
2-[(2-amino-2-phenylpropanoyl)-cyclopentylamino]acetic acid
CID 62488951
N-(3-aminopropyl)-N-cyclobutyl-3-phenylpropanamide
CID 102873861
N-(3-aminopropyl)-N-cyclohexyl-2-phenoxyacetamide
CID 43319389
2-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-2-phenylpropanamide
CID 62489113
N-(3-aminopropyl)-N-cycloheptyl-3,3-dimethylbutanamide
CID 43319428
2-(4-aminophenyl)-N-cyclopropyl-2-methyl-N-propylpropanamide
CID 80556057

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide (CID 43136808) is N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide is CC(C)(C(=O)N(CCCN)C1CCCC1)c1ccccc1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide?
The InChIKey is CROWNFPNXRKNGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-18(2,15-9-4-3-5-10-15)17(21)20(14-8-13-19)16-11-6-7-12-16/h3-5,9-10,16H,6-8,11-14,19H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide?
N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide has a molecular weight of 288.43 g/mol, XLogP of 3.08, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide is sourced from PubChem (CID 43136808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).