4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine

C17H34N2 — CID 742513

IUPAC4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine
SMILESCC(C)(C)C1CCC(NCCN2CCCCC2)CC1
InChIInChI=1S/C17H34N2/c1-17(2,3)15-7-9-16(10-8-15)18-11-14-19-12-5-4-6-13-19/h15-16,18H,4-14H2,1-3H3
InChIKeyOLAGXZPJGUQFRS-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds4

About 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine

4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine (PubChem CID 742513) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine
PubChem CID742513
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine
SMILESCC(C)(C)C1CCC(NCCN2CCCCC2)CC1
InChIInChI=1S/C17H34N2/c1-17(2,3)15-7-9-16(10-8-15)18-11-14-19-12-5-4-6-13-19/h15-16,18H,4-14H2,1-3H3
InChIKeyOLAGXZPJGUQFRS-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(azepan-1-yl)ethyl]-4-tert-butylcyclohexan-1-amine
CID 63455790
N-[2-(azepan-1-yl)ethyl]cyclopropanamine
CID 54773126
N-(2-pyrrolidin-1-ylethyl)cyclopropanamine
CID 54773109
N-(2-pyrrolidin-1-ylethyl)cyclohexanamine
CID 43181622
4-methyl-N-(2-pyrrolidin-1-ylethyl)cyclohexan-1-amine;dihydrochloride
CID 154577414
4-propyl-N-(2-pyrrolidin-1-ylethyl)cycloheptan-1-amine
CID 65087017
N-[2-(azepan-1-yl)ethyl]-1-ethylpiperidin-4-amine
CID 61240570
N-[2-(azepan-1-yl)ethyl]thian-4-amine
CID 60751888
3-methyl-N-(2-pyrrolidin-1-ylethyl)cyclopentan-1-amine
CID 64501657
3-ethyl-N-(2-piperidin-1-ylethyl)cyclopentan-1-amine
CID 64500277
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexanamine
CID 60701363
N-[5-(azocan-1-yl)pentyl]cyclopropanamine
CID 55070436

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine?
The IUPAC name of 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine (CID 742513) is 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine?
The canonical SMILES for 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine is CC(C)(C)C1CCC(NCCN2CCCCC2)CC1.
What is the InChIKey of 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine?
The InChIKey is OLAGXZPJGUQFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-17(2,3)15-7-9-16(10-8-15)18-11-14-19-12-5-4-6-13-19/h15-16,18H,4-14H2,1-3H3.
What are the key properties of 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine?
4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine is sourced from PubChem (CID 742513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).