1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea

C19H24N6O — CID 125445653

IUPAC1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea
SMILESCCn1cnnc1[C@@H](C)NC(=O)N(Cc1ccc2[nH]ccc2c1)C1CC1
InChIInChI=1S/C19H24N6O/c1-3-24-12-21-23-18(24)13(2)22-19(26)25(16-5-6-16)11-14-4-7-17-15(10-14)8-9-20-17/h4,7-10,12-13,16,20H,3,5-6,11H2,1-2H3,(H,22,26)/t13-/m1/s1
InChIKeyUCXCWQFGCBDCKF-CYBMUJFWSA-N
MW352.44 g/mol
LogP3.21
Rot. Bonds6

About 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea

1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea (PubChem CID 125445653) has the molecular formula C19H24N6O and a molecular weight of 352.44 g/mol. Its IUPAC name is 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea
PubChem CID125445653
Molecular FormulaC19H24N6O
Molecular Weight352.44 g/mol
Exact Mass352.20
IUPAC Name1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea
SMILESCCn1cnnc1[C@@H](C)NC(=O)N(Cc1ccc2[nH]ccc2c1)C1CC1
InChIInChI=1S/C19H24N6O/c1-3-24-12-21-23-18(24)13(2)22-19(26)25(16-5-6-16)11-14-4-7-17-15(10-14)8-9-20-17/h4,7-10,12-13,16,20H,3,5-6,11H2,1-2H3,(H,22,26)/t13-/m1/s1
InChIKeyUCXCWQFGCBDCKF-CYBMUJFWSA-N
XLogP3.21
TPSA78.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea 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

1-cyclopropyl-1-(1H-indol-5-ylmethyl)-3-[1-(6-methyl-2-pyridinyl)propyl]urea
CID 131936362
1-cyclopropyl-3-(1-ethylpyrazol-4-yl)-1-(1H-indol-5-ylmethyl)urea
CID 118766067
N-cyclopropyl-N-(1H-indol-5-ylmethyl)-2-pyrazol-1-ylbutanamide
CID 72883487
N-cyclopropyl-N-(1H-indol-5-ylmethyl)-2-methoxypyrimidine-5-carboxamide
CID 119069823
cis-(1R,3S)-3-[cyclopropyl(1H-indol-5-ylmethyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 74243543
N-cyclopropyl-2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(1H-indol-5-ylmethyl)acetamide
CID 77094540
2-bromo-N-cyclopropyl-N-(1H-indol-5-ylmethyl)benzamide
CID 39313071
N-cyclopropyl-N-(1H-indol-5-ylmethyl)-3,4,5-trimethoxybenzamide
CID 39313525
N-cyclopropyl-N-(1H-indol-5-ylmethyl)-2-(2-oxoazepan-1-yl)acetamide
CID 118789700
N-cyclopropyl-N-(1H-indol-6-ylmethyl)-2-methoxyacetamide
CID 39378124
N-cyclopropyl-N-(1H-indol-5-ylmethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide
CID 70784252
N-cyclopropyl-N-(1H-indol-5-ylmethyl)-2,4-dimethoxybenzamide
CID 39348998

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea?
The IUPAC name of 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea (CID 125445653) is 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea.
What is the SMILES notation for 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea?
The canonical SMILES for 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea is CCn1cnnc1[C@@H](C)NC(=O)N(Cc1ccc2[nH]ccc2c1)C1CC1.
What is the InChIKey of 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea?
The InChIKey is UCXCWQFGCBDCKF-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H24N6O/c1-3-24-12-21-23-18(24)13(2)22-19(26)25(16-5-6-16)11-14-4-7-17-15(10-14)8-9-20-17/h4,7-10,12-13,16,20H,3,5-6,11H2,1-2H3,(H,22,26)/t13-/m1/s1.
What are the key properties of 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea?
1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea has a molecular weight of 352.44 g/mol, XLogP of 3.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[(1R)-1-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(1H-indol-5-ylmethyl)urea is sourced from PubChem (CID 125445653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).