2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide

C26H35N3O — CID 174514506

IUPAC2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide
SMILESCCNC1(c2ccccc2C(N)=O)CCN(C2CCCCC2c2ccccc2)CC1
InChIInChI=1S/C26H35N3O/c1-2-28-26(23-14-8-6-13-22(23)25(27)30)16-18-29(19-17-26)24-15-9-7-12-21(24)20-10-4-3-5-11-20/h3-6,8,10-11,13-14,21,24,28H,2,7,9,12,15-19H2,1H3,(H2,27,30)
InChIKeyXUGCUDNODSCTNN-UHFFFAOYSA-N
MW405.59 g/mol
LogP4.41
Rot. Bonds6

About 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide

2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide (PubChem CID 174514506) has the molecular formula C26H35N3O and a molecular weight of 405.59 g/mol. Its IUPAC name is 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide
PubChem CID174514506
Molecular FormulaC26H35N3O
Molecular Weight405.59 g/mol
Exact Mass405.28
IUPAC Name2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide
SMILESCCNC1(c2ccccc2C(N)=O)CCN(C2CCCCC2c2ccccc2)CC1
InChIInChI=1S/C26H35N3O/c1-2-28-26(23-14-8-6-13-22(23)25(27)30)16-18-29(19-17-26)24-15-9-7-12-21(24)20-10-4-3-5-11-20/h3-6,8,10-11,13-14,21,24,28H,2,7,9,12,15-19H2,1H3,(H2,27,30)
InChIKeyXUGCUDNODSCTNN-UHFFFAOYSA-N
XLogP4.41
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.59
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-phenylcyclohexyl)-4-(propan-2-ylamino)piperidine-4-carboxamide
CID 69486342
4-amino-N-methyl-1-[(2S)-2-phenylcyclohexyl]piperidine-4-carboxamide
CID 163920403
1-[(1R,2R)-2-phenylcyclohexyl]-4-(propan-2-ylamino)piperidine-4-carbonitrile
CID 69487621
2-[(2R)-2-methyl-4-(2-phenylcyclohexyl)piperazin-1-yl]acetic acid
CID 59590179
1-(2-phenylcyclohexyl)piperidin-3-amine
CID 105402048
2-methyl-N-phenyl-N-[1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide
CID 91172689
N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine
CID 105402237
1-(cyclopropylmethyl)-8-[(1R,2R)-2-phenylcyclohexyl]-1,3,8-triazaspiro[4.5]decan-4-one
CID 69486557
1-benzyl-8-(2-phenylcyclohexyl)-1,3,8-triazaspiro[4.5]decan-4-one
CID 18441785
tert-butyl 2-(2-phenylcyclohexyl)-2,7-diazaspiro[3.5]nonane-7-carboxylate
CID 167141572
N-phenyl-N-[1-[(1R,2R)-2-phenylcyclohexyl]piperidin-4-yl]benzamide
CID 91480833
8-[(1S,2S)-2-phenylcyclohexyl]-1-(3,3,3-trifluoropropyl)-1,3,8-triazaspiro[4.5]dec-2-en-4-one
CID 58820545

Frequently Asked Questions

What is the IUPAC name of 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide (CID 174514506) is 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide is CCNC1(c2ccccc2C(N)=O)CCN(C2CCCCC2c2ccccc2)CC1.
What is the InChIKey of 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide?
The InChIKey is XUGCUDNODSCTNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H35N3O/c1-2-28-26(23-14-8-6-13-22(23)25(27)30)16-18-29(19-17-26)24-15-9-7-12-21(24)20-10-4-3-5-11-20/h3-6,8,10-11,13-14,21,24,28H,2,7,9,12,15-19H2,1H3,(H2,27,30).
What are the key properties of 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide?
2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide has a molecular weight of 405.59 g/mol, XLogP of 4.41, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(ethylamino)-1-(2-phenylcyclohexyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 174514506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).