N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide

C15H23N3O — CID 146284623

IUPACN-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide
SMILESCNc1c(C(=O)NCC2CC2)c2c(n1C)CCCC2
InChIInChI=1S/C15H23N3O/c1-16-14-13(15(19)17-9-10-7-8-10)11-5-3-4-6-12(11)18(14)2/h10,16H,3-9H2,1-2H3,(H,17,19)
InChIKeyNBWKMHAJTOKZTO-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.09
Rot. Bonds4

About N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide

N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide (PubChem CID 146284623) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide
PubChem CID146284623
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide
SMILESCNc1c(C(=O)NCC2CC2)c2c(n1C)CCCC2
InChIInChI=1S/C15H23N3O/c1-16-14-13(15(19)17-9-10-7-8-10)11-5-3-4-6-12(11)18(14)2/h10,16H,3-9H2,1-2H3,(H,17,19)
InChIKeyNBWKMHAJTOKZTO-UHFFFAOYSA-N
XLogP2.09
TPSA46.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropylethanone;N-(cyclopropylmethyl)-2-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 153377093
N-(cyclopropylmethyl)-1-methylimidazole-4-carboxamide
CID 130626722
N-[(4-chlorocyclohexyl)methyl]-2,4,6-trimethylbenzamide
CID 106133711
N-[(4-bromocyclohexyl)methyl]-2,4,6-trimethylbenzamide
CID 106134544
2-(cyclopropylmethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)acetamide
CID 119822846
N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazole-3-carboxamide
CID 86949699
N-(cyclopropylmethyl)-2-methyltriazole-4-carboxamide
CID 130608801
(Z)-N-(cyclopropylmethyl)-2-(2-hydroxycyclohexen-1-yl)-3-(methylamino)but-2-enamide
CID 146284633
1-cyano-N-[(1-methylpiperidin-4-yl)methyl]cyclopropane-1-carboxamide
CID 80592650
3,5-dihydroxy-N-[(1-methylpiperidin-4-yl)methyl]benzamide
CID 104938964
N-(cyclohexylmethyl)-3,4-dimethylbenzamide
CID 55349047
N-[(4-ethylcyclohexyl)methyl]-3,4,5-trifluorobenzamide
CID 63482414

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide (CID 146284623) is N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide is CNc1c(C(=O)NCC2CC2)c2c(n1C)CCCC2.
What is the InChIKey of N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide?
The InChIKey is NBWKMHAJTOKZTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-16-14-13(15(19)17-9-10-7-8-10)11-5-3-4-6-12(11)18(14)2/h10,16H,3-9H2,1-2H3,(H,17,19).
What are the key properties of N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide?
N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-methyl-2-(methylamino)-4,5,6,7-tetrahydroindole-3-carboxamide is sourced from PubChem (CID 146284623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).