4-tert-butyl-N-cyclopropylcyclohexan-1-amine

C13H25N — CID 16770515

IUPAC4-tert-butyl-N-cyclopropylcyclohexan-1-amine
SMILESCC(C)(C)C1CCC(NC2CC2)CC1
InChIInChI=1S/C13H25N/c1-13(2,3)10-4-6-11(7-5-10)14-12-8-9-12/h10-12,14H,4-9H2,1-3H3
InChIKeyXNHVUWXKVFEPAN-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.34
Rot. Bonds2

About 4-tert-butyl-N-cyclopropylcyclohexan-1-amine

4-tert-butyl-N-cyclopropylcyclohexan-1-amine (PubChem CID 16770515) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 4-tert-butyl-N-cyclopropylcyclohexan-1-amine.

Molecular Properties

Compound Name4-tert-butyl-N-cyclopropylcyclohexan-1-amine
PubChem CID16770515
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name4-tert-butyl-N-cyclopropylcyclohexan-1-amine
SMILESCC(C)(C)C1CCC(NC2CC2)CC1
InChIInChI=1S/C13H25N/c1-13(2,3)10-4-6-11(7-5-10)14-12-8-9-12/h10-12,14H,4-9H2,1-3H3
InChIKeyXNHVUWXKVFEPAN-UHFFFAOYSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-tert-butyl-N-cyclopentylcycloheptan-1-amine
CID 65090444
4-tert-butyl-N-[4-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 43434650
4-tert-butyl-N-(3-methylcyclopentyl)cyclohexan-1-amine
CID 114544060
4-tert-butyl-N-(2,2,3,3-tetramethylcyclopropyl)cyclohexan-1-amine
CID 79352272
1,4-ditert-butylcycloheptane
CID 58579546
tert-butylcyclopentane;tert-butylcyclopropane
CID 160905619
[2-[(4-tert-butylcyclohexyl)amino]cyclopentyl]methanol
CID 103700508
4-tert-butyl-N-propan-2-ylcycloheptan-1-amine
CID 65090392
N-(2-bromoethyl)-4-tert-butylcyclohexan-1-amine
CID 8024756
1,4-ditert-butylcyclohexane;bis(1,4-dimethylcyclohexane)
CID 158485591
3-[(4-tert-butylcyclohexyl)amino]piperidin-2-one
CID 62092650
methyl N-(4-tert-butylcyclohexyl)carbamate
CID 58394494

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-cyclopropylcyclohexan-1-amine?
The IUPAC name of 4-tert-butyl-N-cyclopropylcyclohexan-1-amine (CID 16770515) is 4-tert-butyl-N-cyclopropylcyclohexan-1-amine.
What is the SMILES notation for 4-tert-butyl-N-cyclopropylcyclohexan-1-amine?
The canonical SMILES for 4-tert-butyl-N-cyclopropylcyclohexan-1-amine is CC(C)(C)C1CCC(NC2CC2)CC1.
What is the InChIKey of 4-tert-butyl-N-cyclopropylcyclohexan-1-amine?
The InChIKey is XNHVUWXKVFEPAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-13(2,3)10-4-6-11(7-5-10)14-12-8-9-12/h10-12,14H,4-9H2,1-3H3.
What are the key properties of 4-tert-butyl-N-cyclopropylcyclohexan-1-amine?
4-tert-butyl-N-cyclopropylcyclohexan-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-cyclopropylcyclohexan-1-amine is sourced from PubChem (CID 16770515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).