(2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide

C19H25N5O — CID 95607706

IUPAC(2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide
SMILESCc1cnn(CCN[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)c1
InChIInChI=1S/C19H25N5O/c1-14-11-23-24(13-14)10-9-20-15(2)19(25)21-8-7-16-12-22-18-6-4-3-5-17(16)18/h3-6,11-13,15,20,22H,7-10H2,1-2H3,(H,21,25)/t15-/m1/s1
InChIKeyUFWNEZWYOLOPTQ-OAHLLOKOSA-N
MW339.44 g/mol
LogP2.01
Rot. Bonds8

About (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide

(2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide (PubChem CID 95607706) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide.

Molecular Properties

Compound Name(2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide
PubChem CID95607706
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name(2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide
SMILESCc1cnn(CCN[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)c1
InChIInChI=1S/C19H25N5O/c1-14-11-23-24(13-14)10-9-20-15(2)19(25)21-8-7-16-12-22-18-6-4-3-5-17(16)18/h3-6,11-13,15,20,22H,7-10H2,1-2H3,(H,21,25)/t15-/m1/s1
InChIKeyUFWNEZWYOLOPTQ-OAHLLOKOSA-N
XLogP2.01
TPSA74.74 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide with MolForge

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Related Compounds

1-[2-(1H-indol-3-yl)ethyl]-2-methyl-3-[3-(4-methylpyrazol-1-yl)propyl]guanidine;hydroiodide
CID 110996166
(2S)-2-amino-N-[2-(1H-indol-3-yl)ethyl]propanamide;hydrochloride
CID 119263369
N-[2-(1H-indol-3-yl)ethyl]-2-methyltriazole-4-carboxamide
CID 110691403
4-[2-(1H-indol-3-yl)ethylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103496413
N-[2-(1H-indol-3-yl)ethyl]-1-methyltriazole-4-carboxamide
CID 45497188
N-[2-(1H-indol-3-yl)ethyl]-3-(1-methylpyrazol-4-yl)propanamide
CID 60527895
N-[2-(1H-indol-3-yl)ethyl]-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide
CID 51164019
3-bromo-2-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 100943042
(2S)-N-[2-(1H-indol-3-yl)ethyl]-2-(3-oxo-1H-isoindol-2-yl)propanamide
CID 40649871
N-[2-(1H-indol-3-yl)ethyl]-4-methyl-2-pyrrol-1-ylpentanamide
CID 163091654
N-[2-(1H-indol-3-yl)ethyl]-1-methylimidazole-4-carboxamide
CID 103803030
N-[2-(1H-indol-3-yl)ethyl]-N'-propan-2-yloxamide
CID 2026350

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide?
The IUPAC name of (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide (CID 95607706) is (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide.
What is the SMILES notation for (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide?
The canonical SMILES for (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide is Cc1cnn(CCN[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)c1.
What is the InChIKey of (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide?
The InChIKey is UFWNEZWYOLOPTQ-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H25N5O/c1-14-11-23-24(13-14)10-9-20-15(2)19(25)21-8-7-16-12-22-18-6-4-3-5-17(16)18/h3-6,11-13,15,20,22H,7-10H2,1-2H3,(H,21,25)/t15-/m1/s1.
What are the key properties of (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide?
(2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide has a molecular weight of 339.44 g/mol, XLogP of 2.01, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide is sourced from PubChem (CID 95607706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).