N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine

C14H13N5 — CID 43756710

IUPACN-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
SMILESc1cncc(NCc2cn[nH]c2-c2cccnc2)c1
InChIInChI=1S/C14H13N5/c1-3-11(7-15-5-1)14-12(9-18-19-14)8-17-13-4-2-6-16-10-13/h1-7,9-10,17H,8H2,(H,18,19)
InChIKeyWRQKNLRALCBOCP-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.48
Rot. Bonds4

About N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine

N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine (PubChem CID 43756710) has the molecular formula C14H13N5 and a molecular weight of 251.29 g/mol. Its IUPAC name is N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound NameN-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
PubChem CID43756710
Molecular FormulaC14H13N5
Molecular Weight251.29 g/mol
Exact Mass251.12
IUPAC NameN-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
SMILESc1cncc(NCc2cn[nH]c2-c2cccnc2)c1
InChIInChI=1S/C14H13N5/c1-3-11(7-15-5-1)14-12(9-18-19-14)8-17-13-4-2-6-16-10-13/h1-7,9-10,17H,8H2,(H,18,19)
InChIKeyWRQKNLRALCBOCP-UHFFFAOYSA-N
XLogP2.48
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
CID 81498728
3,4-difluoro-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]aniline
CID 43761640
2-iodo-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]aniline
CID 43773509
3-(5-methyl-1H-1,2,4-triazol-3-yl)-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]aniline
CID 78893950
2,2-dimethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]propan-1-amine
CID 61167800
(5-pyridin-3-yl-1H-pyrazol-4-yl)methanol
CID 43753528
N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
CID 43663437
3-bromo-2-methyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]aniline
CID 103890740
1-(2-bromophenyl)-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]methanamine
CID 61402124
N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]butan-2-amine
CID 43756378
N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]cyclobutanamine
CID 62416311
2,2-dimethyl-3-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanenitrile
CID 104587038

Frequently Asked Questions

What is the IUPAC name of N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine?
The IUPAC name of N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine (CID 43756710) is N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine.
What is the SMILES notation for N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine?
The canonical SMILES for N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine is c1cncc(NCc2cn[nH]c2-c2cccnc2)c1.
What is the InChIKey of N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine?
The InChIKey is WRQKNLRALCBOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5/c1-3-11(7-15-5-1)14-12(9-18-19-14)8-17-13-4-2-6-16-10-13/h1-7,9-10,17H,8H2,(H,18,19).
What are the key properties of N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine?
N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine has a molecular weight of 251.29 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 43756710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).