N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide

C19H24N2O2 — CID 87011207

IUPACN-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide
SMILESCc1[nH]c2ccc(C(=O)N(CC3CCOC3)C3CC3)cc2c1C
InChIInChI=1S/C19H24N2O2/c1-12-13(2)20-18-6-3-15(9-17(12)18)19(22)21(16-4-5-16)10-14-7-8-23-11-14/h3,6,9,14,16,20H,4-5,7-8,10-11H2,1-2H3
InChIKeyAYRYQSXXUNINLV-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.43
Rot. Bonds4

About N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide

N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide (PubChem CID 87011207) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide
PubChem CID87011207
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide
SMILESCc1[nH]c2ccc(C(=O)N(CC3CCOC3)C3CC3)cc2c1C
InChIInChI=1S/C19H24N2O2/c1-12-13(2)20-18-6-3-15(9-17(12)18)19(22)21(16-4-5-16)10-14-7-8-23-11-14/h3,6,9,14,16,20H,4-5,7-8,10-11H2,1-2H3
InChIKeyAYRYQSXXUNINLV-UHFFFAOYSA-N
XLogP3.43
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide 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

Frovatriptan
CID 77992
N,N-Dipropylcarboxamidotryptamine
CID 156314
Indolyl quinolinone deriv. 10
CID 5329376
Indolyl quinolinone deriv. 12
CID 5329378
Indolyl quinolinone deriv. 13
CID 5329379
N-(4-carbamoylphenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-carboxamide
CID 15951768
[4-(2-Hydroxyethyl)piperidin-1-Yl](5-Methyl-1h-Indol-2-Yl)methanone
CID 59529932
N-[(2S)-4-methyl-1-oxo-1-[[(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]amino]pentan-2-yl]-1H-indole-2-carboxamide
CID 143239739
3-(5-((4-(aminomethyl)piperidin-1-yl)methyl)-1H-indol-2-yl)-2-oxo-1,2-dihydroquinoline-6-carboxamide
CID 44419929
2-oxo-3-(5-(piperidin-1-ylmethyl)-1H-indol-2-yl)-1,2-dihydroquinoline-6-carboxamide
CID 44419941
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-[(1R)-1-(oxan-4-yl)ethyl]indole-3-carboxamide
CID 122186510
(6S)-6-benzyl-4-(5-cyclopropyl-1H-indole-2-carbonyl)-1-[(3-cyclopropylphenyl)methyl]piperazin-2-one
CID 122600454

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide?
The IUPAC name of N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide (CID 87011207) is N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide.
What is the SMILES notation for N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide?
The canonical SMILES for N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide is Cc1[nH]c2ccc(C(=O)N(CC3CCOC3)C3CC3)cc2c1C.
What is the InChIKey of N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide?
The InChIKey is AYRYQSXXUNINLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-12-13(2)20-18-6-3-15(9-17(12)18)19(22)21(16-4-5-16)10-14-7-8-23-11-14/h3,6,9,14,16,20H,4-5,7-8,10-11H2,1-2H3.
What are the key properties of N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide?
N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide has a molecular weight of 312.41 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,3-dimethyl-N-(oxolan-3-ylmethyl)-1H-indole-5-carboxamide is sourced from PubChem (CID 87011207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).