N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide

C16H24N2O — CID 43319365

IUPACN-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide
SMILESCc1ccccc1C(=O)N(CCCN)C1CCCC1
InChIInChI=1S/C16H24N2O/c1-13-7-2-5-10-15(13)16(19)18(12-6-11-17)14-8-3-4-9-14/h2,5,7,10,14H,3-4,6,8-9,11-12,17H2,1H3
InChIKeyDRNTZACLOMCTSP-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.73
Rot. Bonds5

About N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide

N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide (PubChem CID 43319365) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide
PubChem CID43319365
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide
SMILESCc1ccccc1C(=O)N(CCCN)C1CCCC1
InChIInChI=1S/C16H24N2O/c1-13-7-2-5-10-15(13)16(19)18(12-6-11-17)14-8-3-4-9-14/h2,5,7,10,14H,3-4,6,8-9,11-12,17H2,1H3
InChIKeyDRNTZACLOMCTSP-UHFFFAOYSA-N
XLogP2.73
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminopropyl)-N-cyclobutyl-2-methylbenzamide
CID 102873748
N-(2-bromoethyl)-N-cyclopentyl-2-methylbenzamide
CID 80658813
N-(3-aminopropyl)-N-cyclopentyl-3-methylpyridine-2-carboxamide
CID 62338909
N-(3-aminopropyl)-N-cyclohexyl-2-fluoro-5-methylbenzamide
CID 62515468
N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide
CID 62830761
N-(3-aminopropyl)-N-cyclopentyl-2,4,6-trimethylbenzamide
CID 43319342
N-(3-aminopropyl)-N-cyclopentyl-2,6-difluoro-3-methylbenzamide
CID 82798367
N-(3-aminopropyl)-N-cyclopentyl-2-methoxy-5-methylbenzamide
CID 62504725
N-(3-aminopropyl)-N-cyclopentyl-1,3-dimethylpyrazole-4-carboxamide
CID 102801032
N-(2-aminoethyl)-N-cyclopentyl-4-hydroxy-2-methylbenzamide
CID 107670547
N-(2-chloroethyl)-N-cyclopentyl-2,3-dimethylbenzamide
CID 63391726
N-(2-aminoethyl)-N-cyclobutyl-3-hydroxy-2-methylbenzamide
CID 102874159

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide (CID 43319365) is N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide is Cc1ccccc1C(=O)N(CCCN)C1CCCC1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide?
The InChIKey is DRNTZACLOMCTSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13-7-2-5-10-15(13)16(19)18(12-6-11-17)14-8-3-4-9-14/h2,5,7,10,14H,3-4,6,8-9,11-12,17H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide?
N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide has a molecular weight of 260.38 g/mol, XLogP of 2.73, 5 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-methylbenzamide is sourced from PubChem (CID 43319365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).