N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine

C15H26N4 — CID 171994731

IUPACN-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine
SMILESCc1cc(NC2CCCN(CC(C)(C)C)C2)ncn1
InChIInChI=1S/C15H26N4/c1-12-8-14(17-11-16-12)18-13-6-5-7-19(9-13)10-15(2,3)4/h8,11,13H,5-7,9-10H2,1-4H3,(H,16,17,18)
InChIKeyPVDDKAIALOAQOG-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.71
Rot. Bonds3

About N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine

N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine (PubChem CID 171994731) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine
PubChem CID171994731
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC NameN-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine
SMILESCc1cc(NC2CCCN(CC(C)(C)C)C2)ncn1
InChIInChI=1S/C15H26N4/c1-12-8-14(17-11-16-12)18-13-6-5-7-19(9-13)10-15(2,3)4/h8,11,13H,5-7,9-10H2,1-4H3,(H,16,17,18)
InChIKeyPVDDKAIALOAQOG-UHFFFAOYSA-N
XLogP2.71
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-[1-[(4-methylphenyl)methyl]piperidin-3-yl]pyrimidin-4-amine
CID 171998278
N-[1-[[2-(dimethylamino)pyrimidin-5-yl]methyl]piperidin-3-yl]-6-methylpyrimidin-4-amine
CID 172881008
6-methyl-N-[1-[(3-methylphenyl)methyl]piperidin-3-yl]pyrimidin-4-amine
CID 171998279
N-cyclobutyl-6-methylpyrimidin-4-amine
CID 62416944
N-[1-(2,2-difluoro-2-phosphanylethyl)azetidin-3-yl]-6-methylpyrimidin-4-amine
CID 170045205
N-[4-[[3-[(6-methylpyrimidin-4-yl)amino]piperidin-1-yl]methyl]phenyl]acetamide
CID 171996910
N-[1-(cyclobutylmethyl)piperidin-4-yl]-6-methylpyrimidin-4-amine
CID 126887813
6-methyl-N-[1-(pyrazin-2-ylmethyl)pyrrolidin-3-yl]pyrimidin-4-amine
CID 171996018
6-methyl-N-[1-[(2-methyl-3-pyridinyl)methyl]pyrrolidin-3-yl]pyrimidin-4-amine
CID 171995148
N-(1,2-dimethylpiperidin-4-yl)-6-methylpyrimidin-4-amine
CID 79033350
N-[1-(3-bromo-2-pyridinyl)piperidin-3-yl]-6-methylpyrimidin-4-amine
CID 171994309
6-propan-2-yl-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]pyrimidin-4-amine
CID 126724510

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine?
The IUPAC name of N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine (CID 171994731) is N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine.
What is the SMILES notation for N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine?
The canonical SMILES for N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine is Cc1cc(NC2CCCN(CC(C)(C)C)C2)ncn1.
What is the InChIKey of N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine?
The InChIKey is PVDDKAIALOAQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-12-8-14(17-11-16-12)18-13-6-5-7-19(9-13)10-15(2,3)4/h8,11,13H,5-7,9-10H2,1-4H3,(H,16,17,18).
What are the key properties of N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine?
N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,2-dimethylpropyl)piperidin-3-yl]-6-methylpyrimidin-4-amine is sourced from PubChem (CID 171994731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).