N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide

C21H30N4O2 — CID 126778385

IUPACN-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide
SMILESCCC(=O)N1CCCCC1C(=O)Nc1ccc2ccn(CCN(C)C)c2c1
InChIInChI=1S/C21H30N4O2/c1-4-20(26)25-11-6-5-7-18(25)21(27)22-17-9-8-16-10-12-24(19(16)15-17)14-13-23(2)3/h8-10,12,15,18H,4-7,11,13-14H2,1-3H3,(H,22,27)
InChIKeyWMKNXYCKSQTEGU-UHFFFAOYSA-N
MW370.50 g/mol
LogP2.93
Rot. Bonds6

About N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide

N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide (PubChem CID 126778385) has the molecular formula C21H30N4O2 and a molecular weight of 370.50 g/mol. Its IUPAC name is N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide
PubChem CID126778385
Molecular FormulaC21H30N4O2
Molecular Weight370.50 g/mol
Exact Mass370.24
IUPAC NameN-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide
SMILESCCC(=O)N1CCCCC1C(=O)Nc1ccc2ccn(CCN(C)C)c2c1
InChIInChI=1S/C21H30N4O2/c1-4-20(26)25-11-6-5-7-18(25)21(27)22-17-9-8-16-10-12-24(19(16)15-17)14-13-23(2)3/h8-10,12,15,18H,4-7,11,13-14H2,1-3H3,(H,22,27)
InChIKeyWMKNXYCKSQTEGU-UHFFFAOYSA-N
XLogP2.93
TPSA57.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]cyclopropane-1-carboxamide
CID 119891229
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-2-(1-hydroxycyclopentyl)acetamide
CID 111539901
2-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-2-methylpropanamide
CID 119891239
N-(3-amino-4-methoxyphenyl)-1-propanoylpiperidine-2-carboxamide;hydrochloride
CID 119418982
3-[4-[(1-propanoylpiperidine-2-carbonyl)amino]phenyl]propanoic acid
CID 119252262
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]morpholine-3-carboxamide;dihydrochloride
CID 119891236
2-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120800919
2-methyl-2-[4-[(1-propanoylpiperidine-2-carbonyl)amino]phenyl]propanoic acid
CID 119254003
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119891270
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-2-hydroxy-2-phenylacetamide
CID 111539900
(2S)-2-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-methylpentanamide;dihydrochloride
CID 119891314
4-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-3-methoxybutanamide
CID 120597119

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide?
The IUPAC name of N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide (CID 126778385) is N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide.
What is the SMILES notation for N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide?
The canonical SMILES for N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide is CCC(=O)N1CCCCC1C(=O)Nc1ccc2ccn(CCN(C)C)c2c1.
What is the InChIKey of N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide?
The InChIKey is WMKNXYCKSQTEGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O2/c1-4-20(26)25-11-6-5-7-18(25)21(27)22-17-9-8-16-10-12-24(19(16)15-17)14-13-23(2)3/h8-10,12,15,18H,4-7,11,13-14H2,1-3H3,(H,22,27).
What are the key properties of N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide?
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide has a molecular weight of 370.50 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-1-propanoylpiperidine-2-carboxamide is sourced from PubChem (CID 126778385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).