N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine

C11H23NO — CID 103033275

IUPACN-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine
SMILESCOC(C)(C)CCNC1CC1(C)C
InChIInChI=1S/C11H23NO/c1-10(2)8-9(10)12-7-6-11(3,4)13-5/h9,12H,6-8H2,1-5H3
InChIKeyPXFXZDMKHSONQE-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.19
Rot. Bonds5

About N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine

N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine (PubChem CID 103033275) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine.

Molecular Properties

Compound NameN-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine
PubChem CID103033275
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine
SMILESCOC(C)(C)CCNC1CC1(C)C
InChIInChI=1S/C11H23NO/c1-10(2)8-9(10)12-7-6-11(3,4)13-5/h9,12H,6-8H2,1-5H3
InChIKeyPXFXZDMKHSONQE-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-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

N-(3-methoxy-3-methylbutyl)adamantan-2-amine
CID 106675234
4-chloro-N-(3-methoxy-3-methylbutyl)cyclohexan-1-amine
CID 103037173
N'-(2,2-dimethylcyclopropyl)-3,3-dimethylhexane-1,6-diamine
CID 65296505
N-butyl-2,2-dimethylcyclopropan-1-amine
CID 61223200
1-cyclopropyl-N-(3-methoxy-3-methylbutyl)piperidin-4-amine
CID 106675336
N-(3-methoxy-3-methylbutyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 106675122
1-N-cyclopropyl-2-N-(3-methoxy-3-methylbutyl)propane-1,2-diamine
CID 103019940
N-(3-methoxy-3-methylbutyl)-3-(3-methylbutan-2-yl)oxiran-2-amine
CID 91465673
N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine
CID 106675409
2-cyclopropyl-N-(3-methoxy-3-methylbutyl)oxolan-3-amine
CID 103581014
2,5-dimethoxy-2,5-dimethylhexane
CID 552009
N-(3-methoxy-3-methylbutyl)-2,6-dimethylpiperidin-1-amine
CID 103033530

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine?
The IUPAC name of N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine (CID 103033275) is N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine.
What is the SMILES notation for N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine?
The canonical SMILES for N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine is COC(C)(C)CCNC1CC1(C)C.
What is the InChIKey of N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine?
The InChIKey is PXFXZDMKHSONQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-10(2)8-9(10)12-7-6-11(3,4)13-5/h9,12H,6-8H2,1-5H3.
What are the key properties of N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine?
N-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine has a molecular weight of 185.31 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-(3-methoxy-3-methylbutyl)-2,2-dimethylcyclopropan-1-amine is sourced from PubChem (CID 103033275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).