6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile

C14H18N6 — CID 133304739

IUPAC6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile
SMILESCN(C)C(CNc1cccc(C#N)n1)c1cnn(C)c1
InChIInChI=1S/C14H18N6/c1-19(2)13(11-8-17-20(3)10-11)9-16-14-6-4-5-12(7-15)18-14/h4-6,8,10,13H,9H2,1-3H3,(H,16,18)
InChIKeyDDVVZLCXUYYNQS-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.40
Rot. Bonds5

About 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile

6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile (PubChem CID 133304739) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile
PubChem CID133304739
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC Name6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile
SMILESCN(C)C(CNc1cccc(C#N)n1)c1cnn(C)c1
InChIInChI=1S/C14H18N6/c1-19(2)13(11-8-17-20(3)10-11)9-16-14-6-4-5-12(7-15)18-14/h4-6,8,10,13H,9H2,1-3H3,(H,16,18)
InChIKeyDDVVZLCXUYYNQS-UHFFFAOYSA-N
XLogP1.40
TPSA69.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(6-cyano-2-pyridinyl)amino]-2-(1-methylpyrazol-4-yl)acetic acid
CID 113279573
N,N-dimethyl-1-(1-methylpyrazol-4-yl)-N'-pyrazin-2-ylethane-1,2-diamine
CID 133306662
6-[[(3-hydroxycyclobutyl)-(1-methylpyrazol-4-yl)methyl]amino]pyridine-2-carbonitrile
CID 91770029
N,N-dimethyl-1-(1-methylpyrazol-4-yl)-N'-(2-methylquinolin-4-yl)ethane-1,2-diamine
CID 133306714
N'-[2-(difluoromethyl)quinazolin-4-yl]-N,N-dimethyl-1-(1-methylpyrazol-4-yl)ethane-1,2-diamine
CID 133306764
1-benzyl-3-[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]-2-methylguanidine
CID 111790134
(1R)-N'-[(2R)-1-(1,3-benzothiazol-2-yl)propan-2-yl]-N,N-dimethyl-1-(1-methylpyrazol-4-yl)ethane-1,2-diamine
CID 97232267
1-[(2S)-2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]-3-[(1R)-2-methyl-1-phenylpropyl]urea
CID 95771368
1-[(2S)-2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]-3-[(1S)-2-methyl-1-phenylpropyl]urea
CID 95771367
6-[(1-ethylcyclopropyl)methylamino]pyridine-2-carbonitrile
CID 103736862
6-[[2-(4-aminophenyl)-2-hydroxyethyl]amino]pyridine-2-carbonitrile
CID 64587805
6-[[1-(1-methylpyrazol-4-yl)-2-oxopyrrolidin-3-yl]amino]pyridine-2-carbonitrile
CID 133304730

Frequently Asked Questions

What is the IUPAC name of 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile?
The IUPAC name of 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile (CID 133304739) is 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile.
What is the SMILES notation for 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile?
The canonical SMILES for 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile is CN(C)C(CNc1cccc(C#N)n1)c1cnn(C)c1.
What is the InChIKey of 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile?
The InChIKey is DDVVZLCXUYYNQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c1-19(2)13(11-8-17-20(3)10-11)9-16-14-6-4-5-12(7-15)18-14/h4-6,8,10,13H,9H2,1-3H3,(H,16,18).
What are the key properties of 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile?
6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile has a molecular weight of 270.34 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-(dimethylamino)-2-(1-methylpyrazol-4-yl)ethyl]amino]pyridine-2-carbonitrile is sourced from PubChem (CID 133304739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).