(2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide

C19H27NO3 — CID 71160765

IUPAC(2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide
SMILESO=C([C@H](O)[C@H](O)c1ccccc1)N(CC1CC1)C1CCCCC1
InChIInChI=1S/C19H27NO3/c21-17(15-7-3-1-4-8-15)18(22)19(23)20(13-14-11-12-14)16-9-5-2-6-10-16/h1,3-4,7-8,14,16-18,21-22H,2,5-6,9-13H2/t17-,18-/m1/s1
InChIKeyNRAQCMXFOVFBIA-QZTJIDSGSA-N
MW317.43 g/mol
LogP2.65
Rot. Bonds6

About (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide

(2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide (PubChem CID 71160765) has the molecular formula C19H27NO3 and a molecular weight of 317.43 g/mol. Its IUPAC name is (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide.

Molecular Properties

Compound Name(2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide
PubChem CID71160765
Molecular FormulaC19H27NO3
Molecular Weight317.43 g/mol
Exact Mass317.20
IUPAC Name(2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide
SMILESO=C([C@H](O)[C@H](O)c1ccccc1)N(CC1CC1)C1CCCCC1
InChIInChI=1S/C19H27NO3/c21-17(15-7-3-1-4-8-15)18(22)19(23)20(13-14-11-12-14)16-9-5-2-6-10-16/h1,3-4,7-8,14,16-18,21-22H,2,5-6,9-13H2/t17-,18-/m1/s1
InChIKeyNRAQCMXFOVFBIA-QZTJIDSGSA-N
XLogP2.65
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-N-ethyl-2,2-diphenylacetamide
CID 21210383
3-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-phenylpropanamide;hydrochloride
CID 119950307
(2R)-2-amino-N-cyclohexyl-N-ethyl-2-phenylacetamide
CID 61148081
(2S,3R)-2,3-dihydroxy-N,N-dimethyl-3-phenylpropanamide
CID 102048863
2-(dicyclohexylamino)-1-phenylethanol
CID 10946557
2-[cyclohexylmethyl(methyl)amino]-2-phenylacetic acid
CID 61446245
benzene;N-cyclohexyl-N-(cyclopropylmethyl)-3-hydroxypropanamide;ethane
CID 142880292
N-(cyclohexylmethyl)-N-[(1S,2S)-2-hydroxycyclohexyl]benzamide
CID 11688261
N-(2-aminoethyl)-N-cyclohexyl-2-phenylbutanamide
CID 63753534
3-[cyclohexyl(ethyl)amino]-2-methyl-1-phenylpropan-1-ol
CID 62618121
2-[3-[cyclohexyl(cyclopropylmethyl)carbamoyl]phenoxy]acetic acid
CID 119183937
N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide
CID 63753347

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide?
The IUPAC name of (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide (CID 71160765) is (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide.
What is the SMILES notation for (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide?
The canonical SMILES for (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide is O=C([C@H](O)[C@H](O)c1ccccc1)N(CC1CC1)C1CCCCC1.
What is the InChIKey of (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide?
The InChIKey is NRAQCMXFOVFBIA-QZTJIDSGSA-N. The full InChI is InChI=1S/C19H27NO3/c21-17(15-7-3-1-4-8-15)18(22)19(23)20(13-14-11-12-14)16-9-5-2-6-10-16/h1,3-4,7-8,14,16-18,21-22H,2,5-6,9-13H2/t17-,18-/m1/s1.
What are the key properties of (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide?
(2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide has a molecular weight of 317.43 g/mol, XLogP of 2.65, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-N-cyclohexyl-N-(cyclopropylmethyl)-2,3-dihydroxy-3-phenylpropanamide is sourced from PubChem (CID 71160765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).