[2,2-bis(2-methylpropyl)cyclopropyl]methanamine

C12H25N — CID 114868694

IUPAC[2,2-bis(2-methylpropyl)cyclopropyl]methanamine
SMILESCC(C)CC1(CC(C)C)CC1CN
InChIInChI=1S/C12H25N/c1-9(2)5-12(6-10(3)4)7-11(12)8-13/h9-11H,5-8,13H2,1-4H3
InChIKeyLGCFRTXOLWIUJW-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.04
Rot. Bonds5

About [2,2-bis(2-methylpropyl)cyclopropyl]methanamine

[2,2-bis(2-methylpropyl)cyclopropyl]methanamine (PubChem CID 114868694) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is [2,2-bis(2-methylpropyl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[2,2-bis(2-methylpropyl)cyclopropyl]methanamine
PubChem CID114868694
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name[2,2-bis(2-methylpropyl)cyclopropyl]methanamine
SMILESCC(C)CC1(CC(C)C)CC1CN
InChIInChI=1S/C12H25N/c1-9(2)5-12(6-10(3)4)7-11(12)8-13/h9-11H,5-8,13H2,1-4H3
InChIKeyLGCFRTXOLWIUJW-UHFFFAOYSA-N
XLogP3.04
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-methylpropyl)bicyclo[1.1.0]butane
CID 90914425
[2-methyl-1-(2-methylpropyl)cyclopentyl]methanamine
CID 83529449
(6-propan-2-ylspiro[2.5]octan-2-yl)methanamine
CID 62707779
[2,2,3-trimethyl-3-(2-methylpropyl)cyclopropyl]methanamine
CID 130488700
1-[(2R)-1-amino-2-(aminomethyl)cyclopropyl]-2-methylpropan-1-one
CID 148728147
[7-(2-methylpropyl)spiro[2.5]octan-2-yl]methanamine
CID 107430357
(2,2,3-trimethylcyclopentyl)methanamine
CID 55290108
2-[1-(2-methylpropyl)cyclopropyl]ethanamine
CID 82418022
(5-ethoxyspiro[2.3]hexan-2-yl)methanamine
CID 106824123
2-methyl-2-(3-methylbutyl)cyclopropan-1-amine
CID 62389533
1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane
CID 91220382
1,2,2,3-tetramethyl-1-(2-methylpropyl)cyclobutane
CID 123680951

Frequently Asked Questions

What is the IUPAC name of [2,2-bis(2-methylpropyl)cyclopropyl]methanamine?
The IUPAC name of [2,2-bis(2-methylpropyl)cyclopropyl]methanamine (CID 114868694) is [2,2-bis(2-methylpropyl)cyclopropyl]methanamine.
What is the SMILES notation for [2,2-bis(2-methylpropyl)cyclopropyl]methanamine?
The canonical SMILES for [2,2-bis(2-methylpropyl)cyclopropyl]methanamine is CC(C)CC1(CC(C)C)CC1CN.
What is the InChIKey of [2,2-bis(2-methylpropyl)cyclopropyl]methanamine?
The InChIKey is LGCFRTXOLWIUJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-9(2)5-12(6-10(3)4)7-11(12)8-13/h9-11H,5-8,13H2,1-4H3.
What are the key properties of [2,2-bis(2-methylpropyl)cyclopropyl]methanamine?
[2,2-bis(2-methylpropyl)cyclopropyl]methanamine has a molecular weight of 183.34 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2,2-bis(2-methylpropyl)cyclopropyl]methanamine is sourced from PubChem (CID 114868694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).