2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine

C20H21ClN6 — CID 135320677

IUPAC2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine
SMILESNc1cc(Nc2cc(Cl)ccn2)nc(-n2cnc(C(C3CC3)C3CC3)c2)c1
InChIInChI=1S/C20H21ClN6/c21-14-5-6-23-17(7-14)25-18-8-15(22)9-19(26-18)27-10-16(24-11-27)20(12-1-2-12)13-3-4-13/h5-13,20H,1-4H2,(H3,22,23,25,26)
InChIKeyWYGLMCQCVRKHCK-UHFFFAOYSA-N
MW380.88 g/mol
LogP4.55
Rot. Bonds6

About 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine

2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine (PubChem CID 135320677) has the molecular formula C20H21ClN6 and a molecular weight of 380.88 g/mol. Its IUPAC name is 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine.

Molecular Properties

Compound Name2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine
PubChem CID135320677
Molecular FormulaC20H21ClN6
Molecular Weight380.88 g/mol
Exact Mass380.15
IUPAC Name2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine
SMILESNc1cc(Nc2cc(Cl)ccn2)nc(-n2cnc(C(C3CC3)C3CC3)c2)c1
InChIInChI=1S/C20H21ClN6/c21-14-5-6-23-17(7-14)25-18-8-15(22)9-19(26-18)27-10-16(24-11-27)20(12-1-2-12)13-3-4-13/h5-13,20H,1-4H2,(H3,22,23,25,26)
InChIKeyWYGLMCQCVRKHCK-UHFFFAOYSA-N
XLogP4.55
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.88
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine with MolForge

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Related Compounds

2-[1-[4-chloro-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]-2-pyridinyl]imidazol-4-yl]propan-2-ol
CID 72704256
N-(4-chloro-2-pyridinyl)pyrimidin-2-amine
CID 118249159
4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine
CID 170352602
N-(4-chloro-2-pyridinyl)-7-methyl-1,8-naphthyridin-2-amine
CID 118249117
(4-chloro-2-pyridinyl)hydrazine;hydrochloride
CID 134830338
N-(4-chloro-2-pyridinyl)-2-methoxypyrimidin-4-amine
CID 118238004
2-methyl-6-(4-phenylimidazol-1-yl)-N-(2,4,6-trichlorophenyl)pyrimidin-4-amine
CID 59771349
(2S)-1-[5-[6-[(4-chloro-2-pyridinyl)amino]-2-pyridinyl]-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide
CID 58706739
2-methyl-6-(4-methylimidazol-1-yl)-N-(2,4,6-trichlorophenyl)pyrimidin-4-amine
CID 59771356
2-N-(1-methylpyrazol-3-yl)pyridine-2,4-diamine
CID 79770919
2-N-(4-piperidin-1-ylphenyl)pyridine-2,4-diamine
CID 63179146
2-[2-[(4-chloro-2-pyridinyl)amino]-4-pyridinyl]-N-pyrrolidin-3-ylpyrido[3,4-d]pyrimidin-4-amine
CID 90098602

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine?
The IUPAC name of 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine (CID 135320677) is 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine.
What is the SMILES notation for 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine?
The canonical SMILES for 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine is Nc1cc(Nc2cc(Cl)ccn2)nc(-n2cnc(C(C3CC3)C3CC3)c2)c1.
What is the InChIKey of 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine?
The InChIKey is WYGLMCQCVRKHCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21ClN6/c21-14-5-6-23-17(7-14)25-18-8-15(22)9-19(26-18)27-10-16(24-11-27)20(12-1-2-12)13-3-4-13/h5-13,20H,1-4H2,(H3,22,23,25,26).
What are the key properties of 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine?
2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine has a molecular weight of 380.88 g/mol, XLogP of 4.55, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-chloro-2-pyridinyl)-6-[4-(dicyclopropylmethyl)imidazol-1-yl]pyridine-2,4-diamine is sourced from PubChem (CID 135320677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).