N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine

C12H20N4 — CID 83838042

IUPACN-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nccc(NC2CCNCC2)n1
InChIInChI=1S/C12H20N4/c1-9(2)12-14-8-5-11(16-12)15-10-3-6-13-7-4-10/h5,8-10,13H,3-4,6-7H2,1-2H3,(H,14,15,16)
InChIKeyJLTXNWUKYLERMO-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.76
Rot. Bonds3

About N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine

N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 83838042) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine
PubChem CID83838042
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC NameN-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nccc(NC2CCNCC2)n1
InChIInChI=1S/C12H20N4/c1-9(2)12-14-8-5-11(16-12)15-10-3-6-13-7-4-10/h5,8-10,13H,3-4,6-7H2,1-2H3,(H,14,15,16)
InChIKeyJLTXNWUKYLERMO-UHFFFAOYSA-N
XLogP1.76
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-propan-2-ylpyrimidin-4-amine
CID 130920544
2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride
CID 67373203
N-piperidin-4-yl-4-propan-2-ylpyrimidin-2-amine
CID 58990485
N-piperidin-4-yl-2-propan-2-yl-6-pyridin-3-ylpyrimidin-4-amine
CID 56767060
N-cyclopropyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968411
N-cyclooctyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968823
4-N-[(3S)-pyrrolidin-3-yl]pyrimidine-2,4-diamine
CID 59631600
4-N-cyclooctyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80956154
2-[4-[(2-propan-2-ylpyrimidin-4-yl)amino]cyclohexyl]-6-pyridin-4-ylpyridazin-3-one
CID 126936752
4-methyl-N-piperidin-4-ylpyrimidin-2-amine
CID 59744254
4-methoxy-N-piperidin-4-ylpyridin-2-amine
CID 11458426
N-cyclobutyl-2-methylpyrimidin-4-amine
CID 62784547

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine (CID 83838042) is N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine is CC(C)c1nccc(NC2CCNCC2)n1.
What is the InChIKey of N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is JLTXNWUKYLERMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9(2)12-14-8-5-11(16-12)15-10-3-6-13-7-4-10/h5,8-10,13H,3-4,6-7H2,1-2H3,(H,14,15,16).
What are the key properties of N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine?
N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 83838042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).