1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide

C17H23N3O — CID 119318274

IUPAC1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
SMILESCc1cccc2[nH]cc(CCNC(=O)C3(N)CCCC3)c12
InChIInChI=1S/C17H23N3O/c1-12-5-4-6-14-15(12)13(11-20-14)7-10-19-16(21)17(18)8-2-3-9-17/h4-6,11,20H,2-3,7-10,18H2,1H3,(H,19,21)
InChIKeyYGTJEFLAGBAJIM-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.41
Rot. Bonds4

About 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide

1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide (PubChem CID 119318274) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
PubChem CID119318274
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
SMILESCc1cccc2[nH]cc(CCNC(=O)C3(N)CCCC3)c12
InChIInChI=1S/C17H23N3O/c1-12-5-4-6-14-15(12)13(11-20-14)7-10-19-16(21)17(18)8-2-3-9-17/h4-6,11,20H,2-3,7-10,18H2,1H3,(H,19,21)
InChIKeyYGTJEFLAGBAJIM-UHFFFAOYSA-N
XLogP2.41
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopropane-1-carboxamide
CID 119774498
1-hydroxy-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
CID 110932725
4-(aminomethyl)-N-[2-(4-methyl-1H-indol-3-yl)ethyl]oxane-4-carboxamide
CID 120931113
1-amino-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide
CID 39058421
1-amino-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119263383
4-(methylamino)-N-[2-(4-methyl-1H-indol-3-yl)ethyl]butanamide
CID 119774506
2-(methylamino)-N-[2-(4-methyl-1H-indol-3-yl)ethyl]acetamide
CID 119774518
1-amino-N-[3-(1H-indol-3-yl)propyl]cyclopentane-1-carboxamide
CID 119320799
1-[[2-(hydroxymethyl)phenyl]methyl]-3-[2-(4-methyl-1H-indol-3-yl)ethyl]urea
CID 111435148
2-(cyclopropylmethylamino)-N-[2-(4-methyl-1H-indol-3-yl)ethyl]acetamide
CID 119774526
1-[[[ethylamino-[2-(4-methyl-1H-indol-3-yl)ethylamino]methylidene]amino]methyl]-N,N-dimethylcyclopentane-1-carboxamide
CID 111572263
3-(2-aminophenyl)-N-[2-(4-methyl-1H-indol-3-yl)ethyl]propanamide;hydrochloride
CID 120610465

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide (CID 119318274) is 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide is Cc1cccc2[nH]cc(CCNC(=O)C3(N)CCCC3)c12.
What is the InChIKey of 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is YGTJEFLAGBAJIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-12-5-4-6-14-15(12)13(11-20-14)7-10-19-16(21)17(18)8-2-3-9-17/h4-6,11,20H,2-3,7-10,18H2,1H3,(H,19,21).
What are the key properties of 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide?
1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 285.39 g/mol, XLogP of 2.41, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119318274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).