4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine

C15H29N — CID 79352031

IUPAC4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
SMILESCC1CCC(NCC2C(C)(C)C2(C)C)CC1
InChIInChI=1S/C15H29N/c1-11-6-8-12(9-7-11)16-10-13-14(2,3)15(13,4)5/h11-13,16H,6-10H2,1-5H3
InChIKeyXEGWMYPEJOXHHD-UHFFFAOYSA-N
MW223.40 g/mol
LogP3.84
Rot. Bonds3

About 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine

4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine (PubChem CID 79352031) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
PubChem CID79352031
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
SMILESCC1CCC(NCC2C(C)(C)C2(C)C)CC1
InChIInChI=1S/C15H29N/c1-11-6-8-12(9-7-11)16-10-13-14(2,3)15(13,4)5/h11-13,16H,6-10H2,1-5H3
InChIKeyXEGWMYPEJOXHHD-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine?
The IUPAC name of 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine (CID 79352031) is 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine is CC1CCC(NCC2C(C)(C)C2(C)C)CC1.
What is the InChIKey of 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine?
The InChIKey is XEGWMYPEJOXHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-11-6-8-12(9-7-11)16-10-13-14(2,3)15(13,4)5/h11-13,16H,6-10H2,1-5H3.
What are the key properties of 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine?
4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 79352031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).