N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine

C17H30N4 — CID 106551771

IUPACN-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine
SMILESCCN(c1nc(C)cn1C1CCCCC1)C1CCCNC1
InChIInChI=1S/C17H30N4/c1-3-20(16-10-7-11-18-12-16)17-19-14(2)13-21(17)15-8-5-4-6-9-15/h13,15-16,18H,3-12H2,1-2H3
InChIKeyPWHPMOKFLAUNGL-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.28
Rot. Bonds4

About N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine

N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine (PubChem CID 106551771) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine.

Molecular Properties

Compound NameN-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine
PubChem CID106551771
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC NameN-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine
SMILESCCN(c1nc(C)cn1C1CCCCC1)C1CCCNC1
InChIInChI=1S/C17H30N4/c1-3-20(16-10-7-11-18-12-16)17-19-14(2)13-21(17)15-8-5-4-6-9-15/h13,15-16,18H,3-12H2,1-2H3
InChIKeyPWHPMOKFLAUNGL-UHFFFAOYSA-N
XLogP3.28
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine?
The IUPAC name of N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine (CID 106551771) is N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine.
What is the SMILES notation for N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine?
The canonical SMILES for N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine is CCN(c1nc(C)cn1C1CCCCC1)C1CCCNC1.
What is the InChIKey of N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine?
The InChIKey is PWHPMOKFLAUNGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-3-20(16-10-7-11-18-12-16)17-19-14(2)13-21(17)15-8-5-4-6-9-15/h13,15-16,18H,3-12H2,1-2H3.
What are the key properties of N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine?
N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine has a molecular weight of 290.45 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine is sourced from PubChem (CID 106551771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).