N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide

C17H26N2O2 — CID 106737605

IUPACN-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide
SMILESCCCOc1cccc(C(=O)NC(CN)C2CCCC2)c1
InChIInChI=1S/C17H26N2O2/c1-2-10-21-15-9-5-8-14(11-15)17(20)19-16(12-18)13-6-3-4-7-13/h5,8-9,11,13,16H,2-4,6-7,10,12,18H2,1H3,(H,19,20)
InChIKeyRNYZGCPSYJVILS-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.72
Rot. Bonds7

About N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide

N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide (PubChem CID 106737605) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide
PubChem CID106737605
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide
SMILESCCCOc1cccc(C(=O)NC(CN)C2CCCC2)c1
InChIInChI=1S/C17H26N2O2/c1-2-10-21-15-9-5-8-14(11-15)17(20)19-16(12-18)13-6-3-4-7-13/h5,8-9,11,13,16H,2-4,6-7,10,12,18H2,1H3,(H,19,20)
InChIKeyRNYZGCPSYJVILS-UHFFFAOYSA-N
XLogP2.72
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[(3R)-3-cyclohexyl-3-[(3-propoxybenzoyl)amino]propyl] 3-propoxybenzoate
CID 97027974
N-(2-amino-1-cyclohexylethyl)-3-methoxybenzamide;hydrochloride
CID 119591989
N-cyclohexyl-3-propoxybenzamide
CID 4960053
N-(2-amino-1-cyclopropylethyl)-3-phenoxybenzamide
CID 86813866
3-[(2-amino-1-cyclohexylethyl)carbamoyl]benzoic acid
CID 122153095
N-(2-amino-1-cyclopropyl-2-hydroxyiminoethyl)-3-propoxybenzamide
CID 77039305
N-(2-amino-1-cyclohexylethyl)-3-(dimethylamino)benzamide
CID 115309240
N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide
CID 17197490
N-(3-oxobutan-2-yl)-3-propoxybenzamide
CID 64996689
N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide
CID 26157621
N-(2-amino-1-cyclohexylethyl)-4-(3-methoxypropoxy)benzamide;hydrochloride
CID 119590589
N-(2-amino-1-cyclopropylethyl)-3-pyridin-4-yloxybenzamide;dihydrochloride
CID 86813863

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide (CID 106737605) is N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide is CCCOc1cccc(C(=O)NC(CN)C2CCCC2)c1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide?
The InChIKey is RNYZGCPSYJVILS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-2-10-21-15-9-5-8-14(11-15)17(20)19-16(12-18)13-6-3-4-7-13/h5,8-9,11,13,16H,2-4,6-7,10,12,18H2,1H3,(H,19,20).
What are the key properties of N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide?
N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide has a molecular weight of 290.41 g/mol, XLogP of 2.72, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopentylethyl)-3-propoxybenzamide is sourced from PubChem (CID 106737605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).