2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide

C16H24N2O2 — CID 64824862

IUPAC2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NC(CO)Cc1ccccc1
InChIInChI=1S/C16H24N2O2/c17-15-9-5-4-8-14(15)16(20)18-13(11-19)10-12-6-2-1-3-7-12/h1-3,6-7,13-15,19H,4-5,8-11,17H2,(H,18,20)
InChIKeyUDONNQTZMDTZJW-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.22
Rot. Bonds5

About 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide

2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide (PubChem CID 64824862) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide
PubChem CID64824862
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NC(CO)Cc1ccccc1
InChIInChI=1S/C16H24N2O2/c17-15-9-5-4-8-14(15)16(20)18-13(11-19)10-12-6-2-1-3-7-12/h1-3,6-7,13-15,19H,4-5,8-11,17H2,(H,18,20)
InChIKeyUDONNQTZMDTZJW-UHFFFAOYSA-N
XLogP1.22
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-[(2-aminocyclohexanecarbonyl)amino]-3-phenylpropanoic acid
CID 103869014
4-amino-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]oxolane-3-carboxamide
CID 107863151
2-[[(2R)-1-hydroxy-3-phenylpropan-2-yl]carbamoyl]cyclopropane-1-carboxylic acid
CID 114010079
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]piperidine-2-carboxamide
CID 107860896
4-amino-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]cyclopent-2-ene-1-carboxamide
CID 107863124
N-(1-hydroxy-3-phenylpropan-2-yl)cyclohex-3-ene-1-carboxamide
CID 63261072
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]cyclohex-3-ene-1-carboxamide
CID 107861462
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-7-azabicyclo[2.2.1]heptane-2-carboxamide
CID 107861024
2-(cyclopentylamino)-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]acetamide
CID 107860961
2-cycloheptyl-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]acetamide
CID 102673858
2-hydroxy-N-(1-phenylbutan-2-yl)cyclopentane-1-carboxamide
CID 110015652
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-3-methylcyclohexane-1-carboxamide
CID 164537987

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide (CID 64824862) is 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide is NC1CCCCC1C(=O)NC(CO)Cc1ccccc1.
What is the InChIKey of 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide?
The InChIKey is UDONNQTZMDTZJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c17-15-9-5-4-8-14(15)16(20)18-13(11-19)10-12-6-2-1-3-7-12/h1-3,6-7,13-15,19H,4-5,8-11,17H2,(H,18,20).
What are the key properties of 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide?
2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.22, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 64824862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).