6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine

C17H30N4 — CID 106643134

IUPAC6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine
SMILESCc1cc(N(CC2CCCNC2)C(C)C)nc(C(C)C)n1
InChIInChI=1S/C17H30N4/c1-12(2)17-19-14(5)9-16(20-17)21(13(3)4)11-15-7-6-8-18-10-15/h9,12-13,15,18H,6-8,10-11H2,1-5H3
InChIKeyGKMPQLYPGIZBSB-UHFFFAOYSA-N
MW290.46 g/mol
LogP3.12
Rot. Bonds5

About 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine

6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine (PubChem CID 106643134) has the molecular formula C17H30N4 and a molecular weight of 290.46 g/mol. Its IUPAC name is 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine
PubChem CID106643134
Molecular FormulaC17H30N4
Molecular Weight290.46 g/mol
Exact Mass290.25
IUPAC Name6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine
SMILESCc1cc(N(CC2CCCNC2)C(C)C)nc(C(C)C)n1
InChIInChI=1S/C17H30N4/c1-12(2)17-19-14(5)9-16(20-17)21(13(3)4)11-15-7-6-8-18-10-15/h9,12-13,15,18H,6-8,10-11H2,1-5H3
InChIKeyGKMPQLYPGIZBSB-UHFFFAOYSA-N
XLogP3.12
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.46
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 106644116
6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 106643185
4-[piperidin-3-ylmethyl(propan-2-yl)amino]-2-propan-2-yl-1H-pyrimidin-6-one
CID 136805343
N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrazin-2-amine
CID 106643250
5-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 106642977
N-(piperidin-3-ylmethyl)-N-propan-2-yl-6-propylpyrimidin-4-amine
CID 106643142
4-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrimidin-2-amine
CID 106643074
N-(azetidin-3-yl)-N,6-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 66183116
4-ethoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrimidin-2-amine
CID 106643233
3-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-yl-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
CID 106642983
2-[cyclopropyl(piperidin-3-ylmethyl)amino]-6-methylpyridine-4-carbonitrile
CID 106643778
3-bromo-5-[piperidin-3-ylmethyl(propan-2-yl)amino]benzonitrile
CID 106643007

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine?
The IUPAC name of 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine (CID 106643134) is 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine is Cc1cc(N(CC2CCCNC2)C(C)C)nc(C(C)C)n1.
What is the InChIKey of 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine?
The InChIKey is GKMPQLYPGIZBSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-12(2)17-19-14(5)9-16(20-17)21(13(3)4)11-15-7-6-8-18-10-15/h9,12-13,15,18H,6-8,10-11H2,1-5H3.
What are the key properties of 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine?
6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine has a molecular weight of 290.46 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(piperidin-3-ylmethyl)-N,2-di(propan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 106643134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).