1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide

C18H24N2O2 — CID 124851434

IUPAC1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide
SMILESCC[C@@H](O)CCNC(=O)c1cc2ccccc2n1CC1CC1
InChIInChI=1S/C18H24N2O2/c1-2-15(21)9-10-19-18(22)17-11-14-5-3-4-6-16(14)20(17)12-13-7-8-13/h3-6,11,13,15,21H,2,7-10,12H2,1H3,(H,19,22)/t15-/m1/s1
InChIKeySFUXONVBMWVZLE-OAHLLOKOSA-N
MW300.40 g/mol
LogP2.94
Rot. Bonds7

About 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide

1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide (PubChem CID 124851434) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide
PubChem CID124851434
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide
SMILESCC[C@@H](O)CCNC(=O)c1cc2ccccc2n1CC1CC1
InChIInChI=1S/C18H24N2O2/c1-2-15(21)9-10-19-18(22)17-11-14-5-3-4-6-16(14)20(17)12-13-7-8-13/h3-6,11,13,15,21H,2,7-10,12H2,1H3,(H,19,22)/t15-/m1/s1
InChIKeySFUXONVBMWVZLE-OAHLLOKOSA-N
XLogP2.94
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide
CID 124854159
N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]-1-ethylindole-2-carboxamide
CID 111662958
N-(3-hydroxypentyl)naphthalene-2-carboxamide
CID 115703584
N-[3-(dimethylamino)-3-oxopropyl]-1-ethylindole-2-carboxamide
CID 47066990
4-(cyclopropylmethyl)-1-methyl-N-propylpyrrolo[3,2-b]indole-2-carboxamide
CID 97407118
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide
CID 55930331
1-benzyl-N-[(1-methylpiperidin-4-yl)methyl]indole-2-carboxamide
CID 86877683
1-ethyl-N-[[1-(1-hydroxy-2-methylpropyl)cyclopropyl]methyl]indole-2-carboxamide
CID 75444716
N-[[(3R)-1-(3,4-difluorophenyl)pyrrolidin-3-yl]methyl]-1-ethylindole-2-carboxamide
CID 95586466
1-ethyl-N-prop-2-ynylindole-2-carboxamide
CID 47335095
4-(cyclopropylmethyl)-1-N,1-N-dimethyl-2-N-propylpyrrolo[3,2-b]indole-1,2-dicarboxamide
CID 97442031
4-(cyclopropylmethyl)-N-[(2-fluorophenyl)methyl]thieno[3,2-b]pyrrole-5-carboxamide
CID 46039194

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide?
The IUPAC name of 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide (CID 124851434) is 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide.
What is the SMILES notation for 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide?
The canonical SMILES for 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide is CC[C@@H](O)CCNC(=O)c1cc2ccccc2n1CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide?
The InChIKey is SFUXONVBMWVZLE-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-2-15(21)9-10-19-18(22)17-11-14-5-3-4-6-16(14)20(17)12-13-7-8-13/h3-6,11,13,15,21H,2,7-10,12H2,1H3,(H,19,22)/t15-/m1/s1.
What are the key properties of 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide?
1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide has a molecular weight of 300.40 g/mol, XLogP of 2.94, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide is sourced from PubChem (CID 124851434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).