N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide

C16H16N4O — CID 63318987

IUPACN-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide
SMILESCN(C)c1ccncc1NC(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C16H16N4O/c1-20(2)15-6-7-17-10-14(15)19-16(21)12-4-3-11-5-8-18-13(11)9-12/h3-10,18H,1-2H3,(H,19,21)
InChIKeyRQRYTQREDSKSGC-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.88
Rot. Bonds3

About N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide

N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide (PubChem CID 63318987) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide
PubChem CID63318987
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC NameN-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide
SMILESCN(C)c1ccncc1NC(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C16H16N4O/c1-20(2)15-6-7-17-10-14(15)19-16(21)12-4-3-11-5-8-18-13(11)9-12/h3-10,18H,1-2H3,(H,19,21)
InChIKeyRQRYTQREDSKSGC-UHFFFAOYSA-N
XLogP2.88
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Indoramin
CID 33625
3-(1-(3-(Dimethylamino)propyl)-1H-indol-3-yl)-4-(1H-indol-3-yl)-1H-pyrrole-2,5-dione
CID 2396
LY-517717
CID 9939865
FG-7142
CID 4375
Indoramin hydrochloride
CID 38102
Tryptamide
CID 65768
1H-indole-3-carboxamide
CID 2192542
5-Fluoro CUMYL-PICA
CID 117650397
4-Fluoro-N-(3-(1-methyl-4-piperidinyl)-1H-indol-5-yl)benzamide
CID 5311258
1-(1H-Indol-3-yl)-2-(1-piperidinyl)ethanone
CID 34864
N-(1H-indol-5-yl)benzamide
CID 2814138
4-fluoro-N-(1H-indol-5-yl)benzamide
CID 2814506

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide?
The IUPAC name of N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide (CID 63318987) is N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide.
What is the SMILES notation for N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide?
The canonical SMILES for N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide is CN(C)c1ccncc1NC(=O)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide?
The InChIKey is RQRYTQREDSKSGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-20(2)15-6-7-17-10-14(15)19-16(21)12-4-3-11-5-8-18-13(11)9-12/h3-10,18H,1-2H3,(H,19,21).
What are the key properties of N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide?
N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 2.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)-3-pyridinyl]-1H-indole-6-carboxamide is sourced from PubChem (CID 63318987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).