2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine

C14H33N3O — CID 23363407

IUPAC2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine
SMILESCCCC(CN(CCC)CCC)C(N)=O.CNC
InChIInChI=1S/C12H26N2O.C2H7N/c1-4-7-11(12(13)15)10-14(8-5-2)9-6-3;1-3-2/h11H,4-10H2,1-3H3,(H2,13,15);3H,1-2H3
InChIKeyHQKWKVCCYFVWOA-UHFFFAOYSA-N
MW259.44 g/mol
LogP1.85
Rot. Bonds9

About 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine

2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine (PubChem CID 23363407) has the molecular formula C14H33N3O and a molecular weight of 259.44 g/mol. Its IUPAC name is 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine.

Molecular Properties

Compound Name2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine
PubChem CID23363407
Molecular FormulaC14H33N3O
Molecular Weight259.44 g/mol
Exact Mass259.26
IUPAC Name2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine
SMILESCCCC(CN(CCC)CCC)C(N)=O.CNC
InChIInChI=1S/C12H26N2O.C2H7N/c1-4-7-11(12(13)15)10-14(8-5-2)9-6-3;1-3-2/h11H,4-10H2,1-3H3,(H2,13,15);3H,1-2H3
InChIKeyHQKWKVCCYFVWOA-UHFFFAOYSA-N
XLogP1.85
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(dipropylamino)methyl]pentanamide
CID 23363408
ethane;2-ethylpentanamide
CID 178117178
2-ethylpentanamide;hydrochloride
CID 121334657
2-propylhexanamide
CID 19818979
1-N,1-N-dipropylpentane-1,2-diamine
CID 43650406
dodecane-2,4,6,8-tetracarboxamide
CID 89075509
5-hydroxy-2-propylpentanamide
CID 21402979
methyl (2S)-3-(dipropylamino)-2-methylpropanoate
CID 92938899
methyl 3-(dipropylamino)-2-methylpropanoate
CID 3015534
4-(dipropylamino)-2-(propylamino)butanamide
CID 63028004
(4R)-4-carbamoylheptanoic acid
CID 171618269
N-ethoxy-2-propylpentanamide
CID 115532275

Frequently Asked Questions

What is the IUPAC name of 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine?
The IUPAC name of 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine (CID 23363407) is 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine.
What is the SMILES notation for 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine?
The canonical SMILES for 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine is CCCC(CN(CCC)CCC)C(N)=O.CNC.
What is the InChIKey of 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine?
The InChIKey is HQKWKVCCYFVWOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O.C2H7N/c1-4-7-11(12(13)15)10-14(8-5-2)9-6-3;1-3-2/h11H,4-10H2,1-3H3,(H2,13,15);3H,1-2H3.
What are the key properties of 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine?
2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine has a molecular weight of 259.44 g/mol, XLogP of 1.85, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(dipropylamino)methyl]pentanamide;N-methylmethanamine is sourced from PubChem (CID 23363407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).