N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine

C12H23NO — CID 115713100

IUPACN-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine
SMILESCC(CC1CCCO1)NCC1CC1C
InChIInChI=1S/C12H23NO/c1-9-6-11(9)8-13-10(2)7-12-4-3-5-14-12/h9-13H,3-8H2,1-2H3
InChIKeyFMVBYINUXLQOOV-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.19
Rot. Bonds5

About N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine

N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine (PubChem CID 115713100) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine.

Molecular Properties

Compound NameN-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine
PubChem CID115713100
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC NameN-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine
SMILESCC(CC1CCCO1)NCC1CC1C
InChIInChI=1S/C12H23NO/c1-9-6-11(9)8-13-10(2)7-12-4-3-5-14-12/h9-13H,3-8H2,1-2H3
InChIKeyFMVBYINUXLQOOV-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-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

N-methyl-1-(oxolan-2-yl)propan-2-amine
CID 60819551
2,3-dimethyl-N-[1-(oxolan-2-yl)propan-2-yl]butan-1-amine
CID 115722687
N-[1-(oxolan-2-yl)propan-2-yl]pentan-1-amine
CID 115705777
2-N-[[(2S)-oxolan-2-yl]methyl]-1-N-propan-2-ylpropane-1,2-diamine
CID 104856010
N-[[(2S)-oxolan-2-yl]methyl]pent-4-en-2-amine
CID 166665828
1-(oxolan-2-yl)-N-(2-prop-2-enylsulfanylethyl)propan-2-amine
CID 115889004
N-(2-ethylsulfonylethyl)-1-(oxolan-2-yl)propan-2-amine
CID 115716501
N-benzyl-1-(oxolan-2-yl)propan-2-amine
CID 122156962
N-(oxolan-2-ylmethyl)propan-2-amine;hydrochloride
CID 172772952
(2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine
CID 28571154
1-(oxolan-2-yl)-N-[1-(oxolan-2-yl)ethyl]propan-2-amine
CID 115709344
3-(oxolan-2-ylmethylamino)butan-1-ol
CID 83177846

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine?
The IUPAC name of N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine (CID 115713100) is N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine.
What is the SMILES notation for N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine?
The canonical SMILES for N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine is CC(CC1CCCO1)NCC1CC1C.
What is the InChIKey of N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine?
The InChIKey is FMVBYINUXLQOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9-6-11(9)8-13-10(2)7-12-4-3-5-14-12/h9-13H,3-8H2,1-2H3.
What are the key properties of N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine?
N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine has a molecular weight of 197.32 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylcyclopropyl)methyl]-1-(oxolan-2-yl)propan-2-amine is sourced from PubChem (CID 115713100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).