N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide

C14H16N2O — CID 34829550

IUPACN-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide
SMILESCc1[nH]c2ccccc2c1C(=O)NCC1CC1
InChIInChI=1S/C14H16N2O/c1-9-13(14(17)15-8-10-6-7-10)11-4-2-3-5-12(11)16-9/h2-5,10,16H,6-8H2,1H3,(H,15,17)
InChIKeyNCHGFVWQSXRENR-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.62
Rot. Bonds3

About N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide

N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide (PubChem CID 34829550) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide
PubChem CID34829550
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC NameN-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide
SMILESCc1[nH]c2ccccc2c1C(=O)NCC1CC1
InChIInChI=1S/C14H16N2O/c1-9-13(14(17)15-8-10-6-7-10)11-4-2-3-5-12(11)16-9/h2-5,10,16H,6-8H2,1H3,(H,15,17)
InChIKeyNCHGFVWQSXRENR-UHFFFAOYSA-N
XLogP2.62
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(3-hydroxycyclohexyl)methyl]-2-methyl-1H-indole-3-carboxamide
CID 103690934
N-[[1-(4-fluorophenyl)pyrrolidin-3-yl]methyl]-2-methyl-1H-indole-3-carboxamide
CID 167801766
2-(2-methyl-1H-indol-3-yl)-N-[(1-methylpiperidin-4-yl)methyl]-2-oxoacetamide
CID 47093388
N,2-dimethyl-1H-indole-3-carboxamide
CID 20800690
N-(2-bromoprop-2-enyl)-2-methyl-1H-indole-3-carboxamide
CID 47438912
2-methoxy-3-[(2-methyl-1H-indole-3-carbonyl)amino]propanoic acid
CID 106107981
2-cycloheptyl-1-(2-methyl-1H-indol-3-yl)ethanone
CID 114457307
N-(2-hydroxy-2-phenylpropyl)-2-methyl-1H-indole-3-carboxamide
CID 111825055
methyl 2-methyl-1H-indole-3-carboxylate
CID 594174
2-[(2-methyl-1H-indole-3-carbonyl)amino]oxyacetic acid
CID 63930965
3-methyl-4-[(2-methyl-1H-indole-3-carbonyl)amino]butanoic acid
CID 81063960
2-methyl-N-phenylmethoxy-1H-indole-3-carboxamide
CID 32579620

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide (CID 34829550) is N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide is Cc1[nH]c2ccccc2c1C(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide?
The InChIKey is NCHGFVWQSXRENR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-9-13(14(17)15-8-10-6-7-10)11-4-2-3-5-12(11)16-9/h2-5,10,16H,6-8H2,1H3,(H,15,17).
What are the key properties of N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide?
N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide has a molecular weight of 228.30 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide is sourced from PubChem (CID 34829550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).