N-(3-aminopropyl)-N-methylheptanamide

C11H24N2O — CID 115737512

IUPACN-(3-aminopropyl)-N-methylheptanamide
SMILESCCCCCCC(=O)N(C)CCCN
InChIInChI=1S/C11H24N2O/c1-3-4-5-6-8-11(14)13(2)10-7-9-12/h3-10,12H2,1-2H3
InChIKeyPFEWOEYDJWXXCV-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.76
Rot. Bonds8

About N-(3-aminopropyl)-N-methylheptanamide

N-(3-aminopropyl)-N-methylheptanamide (PubChem CID 115737512) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-methylheptanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-methylheptanamide
PubChem CID115737512
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN-(3-aminopropyl)-N-methylheptanamide
SMILESCCCCCCC(=O)N(C)CCCN
InChIInChI=1S/C11H24N2O/c1-3-4-5-6-8-11(14)13(2)10-7-9-12/h3-10,12H2,1-2H3
InChIKeyPFEWOEYDJWXXCV-UHFFFAOYSA-N
XLogP1.76
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(3-aminopropyl)-N-methylheptanamide 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

N-(3-aminopropyl)-N-methyldecanamide
CID 65447774
N-(3-aminopropyl)-N-methyloctanamide
CID 43125160
N-methyl-N-octylnonanamide
CID 140654825
N-methyl-N-octylheptacosanamide
CID 87394998
N-(3-hydroxypropyl)-N-methyldecanamide
CID 59366231
4-[heptanoyl(methyl)amino]butanoic acid
CID 43172442
N,N-bis(3-aminopropyl)octanamide;dihydrochloride
CID 134306237
10-[methyl(pentyl)amino]-10-oxodecanoic acid
CID 143390074
N-(5-hydroxypentyl)-N-methyldodecanamide
CID 107201995
N-(3-aminopropyl)-N-ethyldecanamide
CID 65447961
4-[6-aminohexanoyl(methyl)amino]butanoic acid
CID 61160590
N-(3-aminopropyl)-N-propylnonanamide
CID 65448334

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-methylheptanamide?
The IUPAC name of N-(3-aminopropyl)-N-methylheptanamide (CID 115737512) is N-(3-aminopropyl)-N-methylheptanamide.
What is the SMILES notation for N-(3-aminopropyl)-N-methylheptanamide?
The canonical SMILES for N-(3-aminopropyl)-N-methylheptanamide is CCCCCCC(=O)N(C)CCCN.
What is the InChIKey of N-(3-aminopropyl)-N-methylheptanamide?
The InChIKey is PFEWOEYDJWXXCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-3-4-5-6-8-11(14)13(2)10-7-9-12/h3-10,12H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-methylheptanamide?
N-(3-aminopropyl)-N-methylheptanamide has a molecular weight of 200.33 g/mol, XLogP of 1.76, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-methylheptanamide is sourced from PubChem (CID 115737512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).