[1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine

C15H30N2O — CID 115445038

IUPAC[1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine
SMILESCC1(CNCC2(CN)CCCCCC2)CCCO1
InChIInChI=1S/C15H30N2O/c1-14(7-6-10-18-14)12-17-13-15(11-16)8-4-2-3-5-9-15/h17H,2-13,16H2,1H3
InChIKeyMGJTUMKJCRORKW-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.44
Rot. Bonds5

About [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine

[1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine (PubChem CID 115445038) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine.

Molecular Properties

Compound Name[1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine
PubChem CID115445038
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name[1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine
SMILESCC1(CNCC2(CN)CCCCCC2)CCCO1
InChIInChI=1S/C15H30N2O/c1-14(7-6-10-18-14)12-17-13-15(11-16)8-4-2-3-5-9-15/h17H,2-13,16H2,1H3
InChIKeyMGJTUMKJCRORKW-UHFFFAOYSA-N
XLogP2.44
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine 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-[1-(aminomethyl)cyclobutyl]-N-[(2-methyloxolan-2-yl)methyl]acetamide
CID 81169258
[1-[[[1-(2-methylpropyl)cyclopentyl]methylamino]methyl]cyclobutyl]methanamine
CID 113311851
N-[[1-(aminomethyl)cycloheptyl]methyl]-2-methylpropan-1-amine
CID 115444997
N-[[4-(aminomethyl)oxan-4-yl]methyl]-1-methylcyclohexan-1-amine
CID 115440047
3,3-dimethyl-1-N-[(2-methyloxolan-2-yl)methyl]butane-1,2-diamine
CID 112556025
2,6-dichloro-4-[[(2-methyloxolan-2-yl)methylamino]methyl]aniline
CID 82841408
7,7-dimethyl-6-[[(2-methyloxolan-2-yl)methylamino]methyl]-2-oxabicyclo[3.2.0]heptan-6-amine
CID 114948187
4-amino-N-[(2-methyloxolan-2-yl)methyl]butanamide;hydrochloride
CID 119322777
4,4,4-trifluoro-N-[(2-methyloxolan-2-yl)methyl]butan-1-amine
CID 115513806
1-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[(2-methyloxolan-2-yl)methyl]methanamine
CID 107911749
N-[[1-(aminomethyl)cyclohexyl]methyl]-1-(oxolan-3-yl)methanamine
CID 115438163
N-[[1-(aminomethyl)cyclopentyl]methyl]-1-(5-methylfuran-2-yl)methanamine
CID 115435543

Frequently Asked Questions

What is the IUPAC name of [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine?
The IUPAC name of [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine (CID 115445038) is [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine.
What is the SMILES notation for [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine?
The canonical SMILES for [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine is CC1(CNCC2(CN)CCCCCC2)CCCO1.
What is the InChIKey of [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine?
The InChIKey is MGJTUMKJCRORKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-14(7-6-10-18-14)12-17-13-15(11-16)8-4-2-3-5-9-15/h17H,2-13,16H2,1H3.
What are the key properties of [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine?
[1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine has a molecular weight of 254.42 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(2-methyloxolan-2-yl)methylamino]methyl]cycloheptyl]methanamine is sourced from PubChem (CID 115445038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).