(4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine

C10H10Cl2N4 — CID 114658334

IUPAC(4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine
SMILESCn1ncc(Cl)c1C(N)c1ccc(Cl)cn1
InChIInChI=1S/C10H10Cl2N4/c1-16-10(7(12)5-15-16)9(13)8-3-2-6(11)4-14-8/h2-5,9H,13H2,1H3
InChIKeyLCDFRIORIFZYHZ-UHFFFAOYSA-N
MW257.12 g/mol
LogP2.17
Rot. Bonds2

About (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine

(4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine (PubChem CID 114658334) has the molecular formula C10H10Cl2N4 and a molecular weight of 257.12 g/mol. Its IUPAC name is (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine
PubChem CID114658334
Molecular FormulaC10H10Cl2N4
Molecular Weight257.12 g/mol
Exact Mass256.03
IUPAC Name(4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine
SMILESCn1ncc(Cl)c1C(N)c1ccc(Cl)cn1
InChIInChI=1S/C10H10Cl2N4/c1-16-10(7(12)5-15-16)9(13)8-3-2-6(11)4-14-8/h2-5,9H,13H2,1H3
InChIKeyLCDFRIORIFZYHZ-UHFFFAOYSA-N
XLogP2.17
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.12
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanol
CID 114644889
(4-chloro-2-fluorophenyl)-(4-chloro-1-methylpyrazol-5-yl)methanamine
CID 114651067
(2-bromo-4-chlorophenyl)-(4-chloro-1-methylpyrazol-5-yl)methanamine
CID 114025423
1-(4-chloro-1-methylpyrazol-5-yl)-2-methoxy-2-methylpropan-1-amine
CID 114657389
(4-bromo-1-ethylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine
CID 114658333
(4-chloro-1-methylpyrazol-5-yl)-(3-methylfuran-2-yl)methanamine
CID 114660739
(4-bromo-2,6-difluorophenyl)-(4-chloro-1-methylpyrazol-5-yl)methanamine
CID 105046832
(1R)-1-(5-chloro-2-pyridinyl)ethanamine;dihydrochloride
CID 75524979
(3-bromophenyl)-(4-chloro-1-methylpyrazol-5-yl)methanamine
CID 114646653
(4-chloro-1-methylpyrazol-5-yl)-(2,4-dibromophenyl)methanamine
CID 107946860
(2-bromo-5-methylphenyl)-(4-chloro-1-methylpyrazol-5-yl)methanamine
CID 105046840
(4-chloro-1-methylpyrazol-5-yl)-(3-methoxythiophen-2-yl)methanamine
CID 105046501

Frequently Asked Questions

What is the IUPAC name of (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine?
The IUPAC name of (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine (CID 114658334) is (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine.
What is the SMILES notation for (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine?
The canonical SMILES for (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine is Cn1ncc(Cl)c1C(N)c1ccc(Cl)cn1.
What is the InChIKey of (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine?
The InChIKey is LCDFRIORIFZYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2N4/c1-16-10(7(12)5-15-16)9(13)8-3-2-6(11)4-14-8/h2-5,9H,13H2,1H3.
What are the key properties of (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine?
(4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine has a molecular weight of 257.12 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanamine is sourced from PubChem (CID 114658334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).