N-(3-amino-4-methylpentyl)-N-methylpropanamide

C10H22N2O — CID 81484424

IUPACN-(3-amino-4-methylpentyl)-N-methylpropanamide
SMILESCCC(=O)N(C)CCC(N)C(C)C
InChIInChI=1S/C10H22N2O/c1-5-10(13)12(4)7-6-9(11)8(2)3/h8-9H,5-7,11H2,1-4H3
InChIKeyQPMHPRPTDGNNAV-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.23
Rot. Bonds5

About N-(3-amino-4-methylpentyl)-N-methylpropanamide

N-(3-amino-4-methylpentyl)-N-methylpropanamide (PubChem CID 81484424) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-N-methylpropanamide.

Molecular Properties

Compound NameN-(3-amino-4-methylpentyl)-N-methylpropanamide
PubChem CID81484424
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-(3-amino-4-methylpentyl)-N-methylpropanamide
SMILESCCC(=O)N(C)CCC(N)C(C)C
InChIInChI=1S/C10H22N2O/c1-5-10(13)12(4)7-6-9(11)8(2)3/h8-9H,5-7,11H2,1-4H3
InChIKeyQPMHPRPTDGNNAV-UHFFFAOYSA-N
XLogP1.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-4-methylpentyl)-2-(diethylamino)-N-methylacetamide;dihydrochloride
CID 119657669
N-(3-amino-4-methylpentyl)-N-methylpentanamide;hydrochloride
CID 119657793
N-(3-amino-4-methylpentyl)-N-methylhexanamide;hydrochloride
CID 119658936
N-(3-amino-4-methylpentyl)-N-methyl-2-propan-2-yloxyacetamide;hydrochloride
CID 119660231
N-(3-amino-4-methylpentyl)-3-methoxy-N-methylpropanamide
CID 81485025
2-[2-[(3-amino-4-methylpentyl)-methylamino]-2-oxoethyl]sulfanylacetamide
CID 119660546
N-(3-amino-4-methylpentyl)-N,2-dimethylbutanamide;hydrochloride
CID 119657234
2-[(3-amino-4-methylpentyl)-methylamino]-N-ethyl-N-methylacetamide
CID 115317830
N-(3-amino-4-methylpentyl)-N,2,2-trimethylbutanamide
CID 81484329
N-(3-amino-4-methylpentyl)-3-methoxy-N,3-dimethylbutanamide
CID 103021642
N-(3-amino-4-methylpentyl)-2,2,2-trifluoro-N-methylacetamide
CID 81483985
N-(3-amino-4-methylpentyl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide
CID 103807711

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylpentyl)-N-methylpropanamide?
The IUPAC name of N-(3-amino-4-methylpentyl)-N-methylpropanamide (CID 81484424) is N-(3-amino-4-methylpentyl)-N-methylpropanamide.
What is the SMILES notation for N-(3-amino-4-methylpentyl)-N-methylpropanamide?
The canonical SMILES for N-(3-amino-4-methylpentyl)-N-methylpropanamide is CCC(=O)N(C)CCC(N)C(C)C.
What is the InChIKey of N-(3-amino-4-methylpentyl)-N-methylpropanamide?
The InChIKey is QPMHPRPTDGNNAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-5-10(13)12(4)7-6-9(11)8(2)3/h8-9H,5-7,11H2,1-4H3.
What are the key properties of N-(3-amino-4-methylpentyl)-N-methylpropanamide?
N-(3-amino-4-methylpentyl)-N-methylpropanamide has a molecular weight of 186.30 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylpentyl)-N-methylpropanamide is sourced from PubChem (CID 81484424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).