N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine

C15H17N5 — CID 114698931

IUPACN-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine
SMILESCc1cc2ncc(CNCc3ccncc3C)cn2n1
InChIInChI=1S/C15H17N5/c1-11-6-16-4-3-14(11)9-17-7-13-8-18-15-5-12(2)19-20(15)10-13/h3-6,8,10,17H,7,9H2,1-2H3
InChIKeyLTZVNWVXHHVZGH-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.03
Rot. Bonds4

About N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine

N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine (PubChem CID 114698931) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine.

Molecular Properties

Compound NameN-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine
PubChem CID114698931
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC NameN-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine
SMILESCc1cc2ncc(CNCc3ccncc3C)cn2n1
InChIInChI=1S/C15H17N5/c1-11-6-16-4-3-14(11)9-17-7-13-8-18-15-5-12(2)19-20(15)10-13/h3-6,8,10,17H,7,9H2,1-2H3
InChIKeyLTZVNWVXHHVZGH-UHFFFAOYSA-N
XLogP2.03
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-pyridin-4-ylethanamine
CID 62405315
N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(1H-pyrazol-4-yl)methanamine
CID 63784556
1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine
CID 62405500
N',N'-dimethyl-N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]butane-1,4-diamine
CID 62406558
(1S)-N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-pyridin-3-ylethanamine
CID 78951012
N-[(3-bromothiophen-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine
CID 78989787
2-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]acetamide
CID 62404238
N-[(3-methyl-4-pyridinyl)methyl]-1-(1-methylpyrrol-3-yl)methanamine
CID 114698730
1-(4-bromothiophen-2-yl)-N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]methanamine
CID 62404239
2,4-dimethyl-N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]aniline
CID 62403520
N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-2-pyrazol-1-ylethanamine
CID 62405842
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine
CID 103275232

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine?
The IUPAC name of N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine (CID 114698931) is N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine.
What is the SMILES notation for N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine?
The canonical SMILES for N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine is Cc1cc2ncc(CNCc3ccncc3C)cn2n1.
What is the InChIKey of N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine?
The InChIKey is LTZVNWVXHHVZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-11-6-16-4-3-14(11)9-17-7-13-8-18-15-5-12(2)19-20(15)10-13/h3-6,8,10,17H,7,9H2,1-2H3.
What are the key properties of N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine?
N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine has a molecular weight of 267.34 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-1-(3-methyl-4-pyridinyl)methanamine is sourced from PubChem (CID 114698931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).