N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide

C13H26N2O2 — CID 119661203

IUPACN-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide
SMILESCC(C)C(N)CCN(C)C(=O)COCC1CC1
InChIInChI=1S/C13H26N2O2/c1-10(2)12(14)6-7-15(3)13(16)9-17-8-11-4-5-11/h10-12H,4-9,14H2,1-3H3
InChIKeyAPKYHIQRPMTQEY-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.24
Rot. Bonds8

About N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide

N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide (PubChem CID 119661203) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide
PubChem CID119661203
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide
SMILESCC(C)C(N)CCN(C)C(=O)COCC1CC1
InChIInChI=1S/C13H26N2O2/c1-10(2)12(14)6-7-15(3)13(16)9-17-8-11-4-5-11/h10-12H,4-9,14H2,1-3H3
InChIKeyAPKYHIQRPMTQEY-UHFFFAOYSA-N
XLogP1.24
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide;hydrochloride
CID 119661202
N-(3-amino-4-methylpentyl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide
CID 103807711
N-(3-amino-4-methylpentyl)-N-methyl-2-propan-2-yloxyacetamide;hydrochloride
CID 119660231
N-(2-cyanoethyl)-2-(cyclopropylmethoxy)-N-methylacetamide
CID 43289622
N-(3-amino-4-methylpentyl)-N-methylpropanamide
CID 81484424
N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methylcyclohexyl)acetamide;hydrochloride
CID 119659726
N-[2-[(3-amino-4-methylpentyl)-methylamino]-2-oxoethyl]-2-cyclohexylacetamide;hydrochloride
CID 119658134
N-(3-amino-4-methylpentyl)-3-methoxy-N-methylpropanamide
CID 81485025
N-(3-amino-4-methylpentyl)-N-methyl-2-phenoxyacetamide
CID 81485024
N-(3-amino-4-methylpentyl)-N-methyl-3-(oxan-4-yloxy)propanamide
CID 119659339
N-(2-cyanoethyl)-2-(cyclopentylmethoxy)-N-methylacetamide
CID 66324117
N-(3-amino-4-methylpentyl)-3-methoxy-N,3-dimethylbutanamide
CID 103021642

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide?
The IUPAC name of N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide (CID 119661203) is N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide.
What is the SMILES notation for N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide?
The canonical SMILES for N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide is CC(C)C(N)CCN(C)C(=O)COCC1CC1.
What is the InChIKey of N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide?
The InChIKey is APKYHIQRPMTQEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10(2)12(14)6-7-15(3)13(16)9-17-8-11-4-5-11/h10-12H,4-9,14H2,1-3H3.
What are the key properties of N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide?
N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide has a molecular weight of 242.36 g/mol, XLogP of 1.24, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylpentyl)-2-(cyclopropylmethoxy)-N-methylacetamide is sourced from PubChem (CID 119661203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).