2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine

C14H21N5 — CID 65197799

IUPAC2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine
SMILESCNCC(C)c1c(C)nc(-c2cnn(C)c2)nc1C
InChIInChI=1S/C14H21N5/c1-9(6-15-4)13-10(2)17-14(18-11(13)3)12-7-16-19(5)8-12/h7-9,15H,6H2,1-5H3
InChIKeyKOVUWKKDPKAMDX-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.82
Rot. Bonds4

About 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine

2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine (PubChem CID 65197799) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine
PubChem CID65197799
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine
SMILESCNCC(C)c1c(C)nc(-c2cnn(C)c2)nc1C
InChIInChI=1S/C14H21N5/c1-9(6-15-4)13-10(2)17-14(18-11(13)3)12-7-16-19(5)8-12/h7-9,15H,6H2,1-5H3
InChIKeyKOVUWKKDPKAMDX-UHFFFAOYSA-N
XLogP1.82
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4,6-dimethyl-2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]-N-methylpropan-1-amine
CID 65197798
N-[[4-methyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]methyl]propan-2-amine
CID 114206474
3-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]propan-1-amine
CID 65197742
N-[2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]ethyl]-2-methylpropan-2-amine
CID 65198217
6-ethyl-N-methyl-2-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 62201696
2-[4,6-dimethyl-2-(2-methylfuran-3-yl)pyrimidin-5-yl]-N-methylpropan-1-amine
CID 104790877
N-methyl-2-[3-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 65196540
2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-(2-methoxyethyl)ethanamine
CID 65198270
1-[6-methyl-2-(1-methylpyrazol-4-yl)pyrimidin-4-yl]propan-2-amine
CID 65197588
2-methyl-N-[[2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]methyl]propan-1-amine
CID 65197740
N,2-dimethyl-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 62530457
[6-methyl-2-(1-methylpyrazol-4-yl)pyrimidin-4-yl]methanamine
CID 65197998

Frequently Asked Questions

What is the IUPAC name of 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine?
The IUPAC name of 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine (CID 65197799) is 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine.
What is the SMILES notation for 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine?
The canonical SMILES for 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine is CNCC(C)c1c(C)nc(-c2cnn(C)c2)nc1C.
What is the InChIKey of 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine?
The InChIKey is KOVUWKKDPKAMDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-9(6-15-4)13-10(2)17-14(18-11(13)3)12-7-16-19(5)8-12/h7-9,15H,6H2,1-5H3.
What are the key properties of 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine?
2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine has a molecular weight of 259.36 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4,6-dimethyl-2-(1-methylpyrazol-4-yl)pyrimidin-5-yl]-N-methylpropan-1-amine is sourced from PubChem (CID 65197799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).