(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide

C24H23ClN2O2 — CID 40918404

IUPAC(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide
SMILESC[C@H](C(=O)N[C@H](CO)Cc1ccccc1)c1ccc2c(c1)[nH]c1ccc(Cl)cc12
InChIInChI=1S/C24H23ClN2O2/c1-15(24(29)26-19(14-28)11-16-5-3-2-4-6-16)17-7-9-20-21-13-18(25)8-10-22(21)27-23(20)12-17/h2-10,12-13,15,19,27-28H,11,14H2,1H3,(H,26,29)/t15-,19-/m0/s1
InChIKeyNSOSKLPLTIHRDN-KXBFYZLASA-N
MW406.91 g/mol
LogP4.80
Rot. Bonds6

About (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide

(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide (PubChem CID 40918404) has the molecular formula C24H23ClN2O2 and a molecular weight of 406.91 g/mol. Its IUPAC name is (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide.

Molecular Properties

Compound Name(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide
PubChem CID40918404
Molecular FormulaC24H23ClN2O2
Molecular Weight406.91 g/mol
Exact Mass406.14
IUPAC Name(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide
SMILESC[C@H](C(=O)N[C@H](CO)Cc1ccccc1)c1ccc2c(c1)[nH]c1ccc(Cl)cc12
InChIInChI=1S/C24H23ClN2O2/c1-15(24(29)26-19(14-28)11-16-5-3-2-4-6-16)17-7-9-20-21-13-18(25)8-10-22(21)27-23(20)12-17/h2-10,12-13,15,19,27-28H,11,14H2,1H3,(H,26,29)/t15-,19-/m0/s1
InChIKeyNSOSKLPLTIHRDN-KXBFYZLASA-N
XLogP4.80
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.91
LogP ≤ 54.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(6-chloro-9H-carbazol-2-yl)-N-(2-hydroxy-1-phenylethyl)propanamide
CID 71710526
(2R)-2-(6-chloro-9H-carbazol-2-yl)-N-[(1S)-2-hydroxy-1-phenylethyl]propanamide
CID 40918719
2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide
CID 71482982
(2R)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2R)-2,3-dihydroxypropyl]propanamide
CID 41087768
(2S)-2-(6-chloro-9H-carbazol-2-yl)propanamide
CID 71483149
(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-(4-methylphenyl)propanamide
CID 41010161
4-[2-(3-chlorophenyl)propanoylamino]-5-phenylpentanoic acid
CID 120547125
(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-(1H-1,2,4-triazol-5-yl)propanamide
CID 97266964
(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid;(2S)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid;tris(4-pyridin-4-ylpyridine)
CID 139196134
(2R)-2-(6-chloro-9H-carbazol-2-yl)-N-(1,3-thiazol-2-yl)propanamide
CID 41062772
1-(diethylamino)ethyl 2-(6-chloro-9H-carbazol-2-yl)propanoate
CID 68796215
ethyl 4-[[(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoyl]amino]piperidine-1-carboxylate
CID 41118330

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide?
The IUPAC name of (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide (CID 40918404) is (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide.
What is the SMILES notation for (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide?
The canonical SMILES for (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide is C[C@H](C(=O)N[C@H](CO)Cc1ccccc1)c1ccc2c(c1)[nH]c1ccc(Cl)cc12.
What is the InChIKey of (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide?
The InChIKey is NSOSKLPLTIHRDN-KXBFYZLASA-N. The full InChI is InChI=1S/C24H23ClN2O2/c1-15(24(29)26-19(14-28)11-16-5-3-2-4-6-16)17-7-9-20-21-13-18(25)8-10-22(21)27-23(20)12-17/h2-10,12-13,15,19,27-28H,11,14H2,1H3,(H,26,29)/t15-,19-/m0/s1.
What are the key properties of (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide?
(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide has a molecular weight of 406.91 g/mol, XLogP of 4.80, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide is sourced from PubChem (CID 40918404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).