N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine

C11H15N5 — CID 154772447

IUPACN-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine
SMILESCc1cncnc1NCc1n[nH]c(C)c1C
InChIInChI=1S/C11H15N5/c1-7-4-12-6-14-11(7)13-5-10-8(2)9(3)15-16-10/h4,6H,5H2,1-3H3,(H,15,16)(H,12,13,14)
InChIKeyMWRIFRSJMBBMJZ-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.74
Rot. Bonds3

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

N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine (PubChem CID 154772447) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine
PubChem CID154772447
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC NameN-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine
SMILESCc1cncnc1NCc1n[nH]c(C)c1C
InChIInChI=1S/C11H15N5/c1-7-4-12-6-14-11(7)13-5-10-8(2)9(3)15-16-10/h4,6H,5H2,1-3H3,(H,15,16)(H,12,13,14)
InChIKeyMWRIFRSJMBBMJZ-UHFFFAOYSA-N
XLogP1.74
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine
CID 146109008
5-bromo-N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-2,6-dimethylpyrimidin-4-amine
CID 136575153
6-cyclopropyl-N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]pyrimidin-4-amine
CID 138031055
N'-(5-methylpyrimidin-4-yl)propane-1,3-diamine
CID 139496375
5-chloro-N-[(3-methyl-2-pyridinyl)methyl]pyrimidin-4-amine
CID 105369414
3-methyl-N-(pyrimidin-5-ylmethyl)pyridin-2-amine
CID 66973402
N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-6-methylpyrimidine-4-carboxamide
CID 136558778
ethane;N-(5-methylpyrimidin-4-yl)acetamide
CID 144640649
5-chloro-N-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]pyrimidin-4-amine
CID 146105482
4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine
CID 79918333
5-methyl-4-N,6-N-bis[(5-methyl-3-pyridinyl)methyl]pyrimidine-4,6-diamine
CID 126820929
N-[(5-methyl-1H-imidazol-4-yl)methyl]pyrimidin-5-amine
CID 107587844

Frequently Asked Questions

What is the IUPAC name of N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine?
The IUPAC name of N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine (CID 154772447) is N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine?
The canonical SMILES for N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine is Cc1cncnc1NCc1n[nH]c(C)c1C.
What is the InChIKey of N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine?
The InChIKey is MWRIFRSJMBBMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-7-4-12-6-14-11(7)13-5-10-8(2)9(3)15-16-10/h4,6H,5H2,1-3H3,(H,15,16)(H,12,13,14).
What are the key properties of N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine?
N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine has a molecular weight of 217.28 g/mol, XLogP of 1.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,5-dimethyl-1H-pyrazol-3-yl)methyl]-5-methylpyrimidin-4-amine is sourced from PubChem (CID 154772447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).