N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide

C17H26N2O2 — CID 43319405

IUPACN-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide
SMILESCOc1cccc(C(=O)N(CCCN)C2CCCCC2)c1
InChIInChI=1S/C17H26N2O2/c1-21-16-10-5-7-14(13-16)17(20)19(12-6-11-18)15-8-3-2-4-9-15/h5,7,10,13,15H,2-4,6,8-9,11-12,18H2,1H3
InChIKeyUOMQOUQSGMDIDJ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.82
Rot. Bonds6

About N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide

N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide (PubChem CID 43319405) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide
PubChem CID43319405
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide
SMILESCOc1cccc(C(=O)N(CCCN)C2CCCCC2)c1
InChIInChI=1S/C17H26N2O2/c1-21-16-10-5-7-14(13-16)17(20)19(12-6-11-18)15-8-3-2-4-9-15/h5,7,10,13,15H,2-4,6,8-9,11-12,18H2,1H3
InChIKeyUOMQOUQSGMDIDJ-UHFFFAOYSA-N
XLogP2.82
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)-N-cycloheptyl-3-fluorobenzamide
CID 43319433
N-(2-chloroethyl)-N-cyclopropyl-3-methoxybenzamide
CID 63394478
methyl 2-[cyclopentyl-(3-methoxybenzoyl)amino]acetate
CID 80717814
N-(3-aminopropyl)-N-cyclopropyl-4-methoxybenzamide
CID 43136784
1-(3-aminopropyl)-1-cyclobutyl-3-(3-methoxyphenyl)urea
CID 102874255
N-cycloheptyl-3-methoxy-N-(3-oxo-3-piperazin-1-ylpropyl)benzamide
CID 50779474
N-(3-aminopropyl)-N-cyclohexylpyridine-3-carboxamide
CID 43319410
N-[2-[acetyl(cycloheptyl)amino]ethyl]-3-methoxybenzamide
CID 113056703
N'-cyclohexyl-N'-(3-methoxyphenyl)propane-1,3-diamine
CID 43319153
N-(3-aminopropyl)-N-cyclopentylpyridine-3-carboxamide
CID 43136838
N-(3-aminopropyl)-N-cycloheptyl-2-methylpyridine-4-carboxamide
CID 106752285
N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide
CID 55241758

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide (CID 43319405) is N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide is COc1cccc(C(=O)N(CCCN)C2CCCCC2)c1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide?
The InChIKey is UOMQOUQSGMDIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-21-16-10-5-7-14(13-16)17(20)19(12-6-11-18)15-8-3-2-4-9-15/h5,7,10,13,15H,2-4,6,8-9,11-12,18H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide?
N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide has a molecular weight of 290.41 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide is sourced from PubChem (CID 43319405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).