N-methylpropan-1-amine

C4H11N — CID 12315

IUPACN-methylpropan-1-amine
SMILESCCCNC
InChIInChI=1S/C4H11N/c1-3-4-5-2/h5H,3-4H2,1-2H3
InChIKeyGVWISOJSERXQBM-UHFFFAOYSA-N
MW73.14 g/mol
LogP0.62
Rot. Bonds2

About N-methylpropan-1-amine

N-methylpropan-1-amine (PubChem CID 12315) has the molecular formula C4H11N and a molecular weight of 73.14 g/mol. Its IUPAC name is N-methylpropan-1-amine.

Molecular Properties

Compound NameN-methylpropan-1-amine
PubChem CID12315
Molecular FormulaC4H11N
Molecular Weight73.14 g/mol
Exact Mass73.09
IUPAC NameN-methylpropan-1-amine
SMILESCCCNC
InChIInChI=1S/C4H11N/c1-3-4-5-2/h5H,3-4H2,1-2H3
InChIKeyGVWISOJSERXQBM-UHFFFAOYSA-N
XLogP0.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50073.14
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Diethylamine
CID 8021
Dipropylamine
CID 8902
Butylethylamine
CID 25914
N-Methylethylamine
CID 12219
N-Methyl-1,3-propanediamine
CID 80511
N-Methylbutylamine
CID 8068
N-Methylputrescine
CID 439791
N-Ethyl-1,3-propanediamine
CID 82727
N-Methylpentylamine
CID 117479
N,N'-Dimethyl-1,3-propanediamine
CID 66978
N,N'-Dimethylputrescine
CID 85238
N-Methylisobutylamine
CID 12249

Frequently Asked Questions

What is the IUPAC name of N-methylpropan-1-amine?
The IUPAC name of N-methylpropan-1-amine (CID 12315) is N-methylpropan-1-amine.
What is the SMILES notation for N-methylpropan-1-amine?
The canonical SMILES for N-methylpropan-1-amine is CCCNC.
What is the InChIKey of N-methylpropan-1-amine?
The InChIKey is GVWISOJSERXQBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N/c1-3-4-5-2/h5H,3-4H2,1-2H3.
What are the key properties of N-methylpropan-1-amine?
N-methylpropan-1-amine has a molecular weight of 73.14 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylpropan-1-amine is sourced from PubChem (CID 12315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).