N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine

C11H23NO — CID 102672134

IUPACN-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine
SMILESCOCC(C)CNCC1CC1(C)C
InChIInChI=1S/C11H23NO/c1-9(8-13-4)6-12-7-10-5-11(10,2)3/h9-10,12H,5-8H2,1-4H3
InChIKeyIMDRFPVXRFPJHJ-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.90
Rot. Bonds6

About N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine

N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine (PubChem CID 102672134) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine
PubChem CID102672134
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine
SMILESCOCC(C)CNCC1CC1(C)C
InChIInChI=1S/C11H23NO/c1-9(8-13-4)6-12-7-10-5-11(10,2)3/h9-10,12H,5-8H2,1-4H3
InChIKeyIMDRFPVXRFPJHJ-UHFFFAOYSA-N
XLogP1.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-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

3-[[(3-methoxy-2-methylpropyl)amino]methyl]cyclobutan-1-ol
CID 116501366
3-methoxy-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propan-1-amine
CID 62657183
1-[[(3-methoxy-2-methylpropyl)amino]methyl]cyclopentan-1-ol
CID 65210997
1-[[(3-methoxy-2-methylpropyl)amino]methyl]-3-methylcyclohexan-1-ol
CID 116501341
5-[[(3-methoxy-2-methylpropyl)amino]methyl]oxolane-2-carboxylic acid
CID 103245618
1-N-(3-methoxy-2-methylpropyl)-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 115688254
1-N-(2,2-dimethylcyclopropyl)-3-methoxypropane-1,2-diamine
CID 81101278
1-N-(3-methoxy-2-methylpropyl)-2-N,2-N,4-trimethylpentane-1,2-diamine
CID 116500832
N-(2,3-dihydro-1-benzofuran-3-ylmethyl)-3-methoxy-2-methylpropan-1-amine
CID 79227069
N-(2,3-dihydro-1-benzothiophen-2-ylmethyl)-3-methoxy-2-methylpropan-1-amine
CID 79223006
3-[(3-methoxy-2-methylpropyl)amino]propane-1,2-diol
CID 76929562
3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol
CID 116501365

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine?
The IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine (CID 102672134) is N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine.
What is the SMILES notation for N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine?
The canonical SMILES for N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine is COCC(C)CNCC1CC1(C)C.
What is the InChIKey of N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine?
The InChIKey is IMDRFPVXRFPJHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(8-13-4)6-12-7-10-5-11(10,2)3/h9-10,12H,5-8H2,1-4H3.
What are the key properties of N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine?
N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxy-2-methylpropan-1-amine is sourced from PubChem (CID 102672134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).