N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine

C15H31N3 — CID 83010584

IUPACN-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine
SMILESCN1CCN(NC2CCC(C(C)(C)C)CC2)CC1
InChIInChI=1S/C15H31N3/c1-15(2,3)13-5-7-14(8-6-13)16-18-11-9-17(4)10-12-18/h13-14,16H,5-12H2,1-4H3
InChIKeyGOGKZAIEMPPDRH-UHFFFAOYSA-N
MW253.43 g/mol
LogP2.34
Rot. Bonds2

About N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine

N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine (PubChem CID 83010584) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine.

Molecular Properties

Compound NameN-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine
PubChem CID83010584
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC NameN-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine
SMILESCN1CCN(NC2CCC(C(C)(C)C)CC2)CC1
InChIInChI=1S/C15H31N3/c1-15(2,3)13-5-7-14(8-6-13)16-18-11-9-17(4)10-12-18/h13-14,16H,5-12H2,1-4H3
InChIKeyGOGKZAIEMPPDRH-UHFFFAOYSA-N
XLogP2.34
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-(oxetan-3-yl)piperazin-1-amine
CID 83008980
4-methyl-N-(1-methylpiperidin-3-yl)piperazin-1-amine
CID 83009082
4-tert-butyl-N-cyclopropylcyclohexan-1-amine
CID 16770515
4-methyl-N-(thiolan-3-yl)piperazin-1-amine
CID 83010396
tert-butylcyclohexane;4-tert-butyl-1-methylpiperidine
CID 162008931
1-N-(1-methylpiperidin-4-yl)piperidine-1,4-diamine
CID 145481101
N-cyclopropylpiperidin-1-amine
CID 57433126
1-N,4-N-di(cyclooctyl)piperazine-1,4-diamine
CID 70099452
N-[2-(azepan-1-yl)ethyl]-4-tert-butylcyclohexan-1-amine
CID 63455790
4-tert-butyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine
CID 742513
N,N-dimethyl-2-[4-[(4-methylpiperazin-1-yl)amino]piperidin-1-yl]acetamide
CID 83009899
N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine
CID 83009098

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine?
The IUPAC name of N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine (CID 83010584) is N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine.
What is the SMILES notation for N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine?
The canonical SMILES for N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine is CN1CCN(NC2CCC(C(C)(C)C)CC2)CC1.
What is the InChIKey of N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine?
The InChIKey is GOGKZAIEMPPDRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-15(2,3)13-5-7-14(8-6-13)16-18-11-9-17(4)10-12-18/h13-14,16H,5-12H2,1-4H3.
What are the key properties of N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine?
N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine has a molecular weight of 253.43 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylcyclohexyl)-4-methylpiperazin-1-amine is sourced from PubChem (CID 83010584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).