2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine

C19H38N2 — CID 63493452

IUPAC2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine
SMILESCCCNC1CCCCCC1CN(C)C1CCCCCC1
InChIInChI=1S/C19H38N2/c1-3-15-20-19-14-10-6-7-11-17(19)16-21(2)18-12-8-4-5-9-13-18/h17-20H,3-16H2,1-2H3
InChIKeyWFEUSMSRVDHRGN-UHFFFAOYSA-N
MW294.53 g/mol
LogP4.59
Rot. Bonds6

About 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine

2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine (PubChem CID 63493452) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine.

Molecular Properties

Compound Name2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine
PubChem CID63493452
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC Name2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine
SMILESCCCNC1CCCCCC1CN(C)C1CCCCCC1
InChIInChI=1S/C19H38N2/c1-3-15-20-19-14-10-6-7-11-17(19)16-21(2)18-12-8-4-5-9-13-18/h17-20H,3-16H2,1-2H3
InChIKeyWFEUSMSRVDHRGN-UHFFFAOYSA-N
XLogP4.59
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine 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-[[cyclohexyl(methyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 62615295
N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine
CID 62615159
N,1-dimethyl-N-[[2-(propylamino)cyclopentyl]methyl]piperidin-3-amine
CID 55094812
2-[[cyclopropyl(methyl)amino]methyl]-N-ethylcyclohexan-1-amine
CID 62616008
N-methyl-N-[[2-(methylamino)cyclohexyl]methyl]cycloheptanamine
CID 62614949
2-[2-[cyclopropyl(methyl)amino]ethyl]-N-propylcyclopentan-1-amine
CID 79569650
2-[methyl-[[2-(propylamino)cyclohexyl]methyl]amino]ethanol
CID 62614770
4-methyl-2-[[methyl-(3-methylcyclohexyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 63494785
N-methyl-N-[[2-(propylamino)cyclohexyl]methyl]aniline
CID 62616342
3-[[cyclopropyl(methyl)amino]methyl]-N-propyloxan-4-amine
CID 103058724
2-[[2-methoxyethyl(methyl)amino]methyl]-N-propylcyclopentan-1-amine
CID 62610889
N,4-dimethyl-N-[[2-(propylamino)cyclohexyl]methyl]aniline
CID 63494623

Frequently Asked Questions

What is the IUPAC name of 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine?
The IUPAC name of 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine (CID 63493452) is 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine.
What is the SMILES notation for 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine?
The canonical SMILES for 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine is CCCNC1CCCCCC1CN(C)C1CCCCCC1.
What is the InChIKey of 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine?
The InChIKey is WFEUSMSRVDHRGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-3-15-20-19-14-10-6-7-11-17(19)16-21(2)18-12-8-4-5-9-13-18/h17-20H,3-16H2,1-2H3.
What are the key properties of 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine?
2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine has a molecular weight of 294.53 g/mol, XLogP of 4.59, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cycloheptyl(methyl)amino]methyl]-N-propylcycloheptan-1-amine is sourced from PubChem (CID 63493452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).