6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide

C19H24N8O — CID 78105681

IUPAC6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide
SMILESCc1nc(Nc2cc(NCC(C)N)ncc2C(N)=O)ccc1-c1cnn(C)c1
InChIInChI=1S/C19H24N8O/c1-11(20)7-22-18-6-16(15(9-23-18)19(21)28)26-17-5-4-14(12(2)25-17)13-8-24-27(3)10-13/h4-6,8-11H,7,20H2,1-3H3,(H2,21,28)(H2,22,23,25,26)
InChIKeyVHPSTABDJKAMLH-UHFFFAOYSA-N
MW380.46 g/mol
LogP1.79
Rot. Bonds7

About 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide

6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide (PubChem CID 78105681) has the molecular formula C19H24N8O and a molecular weight of 380.46 g/mol. Its IUPAC name is 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide
PubChem CID78105681
Molecular FormulaC19H24N8O
Molecular Weight380.46 g/mol
Exact Mass380.21
IUPAC Name6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide
SMILESCc1nc(Nc2cc(NCC(C)N)ncc2C(N)=O)ccc1-c1cnn(C)c1
InChIInChI=1S/C19H24N8O/c1-11(20)7-22-18-6-16(15(9-23-18)19(21)28)26-17-5-4-14(12(2)25-17)13-8-24-27(3)10-13/h4-6,8-11H,7,20H2,1-3H3,(H2,21,28)(H2,22,23,25,26)
InChIKeyVHPSTABDJKAMLH-UHFFFAOYSA-N
XLogP1.79
TPSA136.77 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.46
LogP ≤ 51.79
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide?
The IUPAC name of 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide (CID 78105681) is 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide?
The canonical SMILES for 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide is Cc1nc(Nc2cc(NCC(C)N)ncc2C(N)=O)ccc1-c1cnn(C)c1.
What is the InChIKey of 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide?
The InChIKey is VHPSTABDJKAMLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N8O/c1-11(20)7-22-18-6-16(15(9-23-18)19(21)28)26-17-5-4-14(12(2)25-17)13-8-24-27(3)10-13/h4-6,8-11H,7,20H2,1-3H3,(H2,21,28)(H2,22,23,25,26).
What are the key properties of 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide?
6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide has a molecular weight of 380.46 g/mol, XLogP of 1.79, 7 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminopropylamino)-4-[[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 78105681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).