(1-pyrimidin-4-ylpiperidin-4-yl)methanamine

C10H16N4 — CID 22052431

IUPAC(1-pyrimidin-4-ylpiperidin-4-yl)methanamine
SMILESNCC1CCN(c2ccncn2)CC1
InChIInChI=1S/C10H16N4/c11-7-9-2-5-14(6-3-9)10-1-4-12-8-13-10/h1,4,8-9H,2-3,5-7,11H2
InChIKeySOQIYEUEAKMJCJ-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.65
Rot. Bonds2

About (1-pyrimidin-4-ylpiperidin-4-yl)methanamine

(1-pyrimidin-4-ylpiperidin-4-yl)methanamine (PubChem CID 22052431) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is (1-pyrimidin-4-ylpiperidin-4-yl)methanamine.

Molecular Properties

Compound Name(1-pyrimidin-4-ylpiperidin-4-yl)methanamine
PubChem CID22052431
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name(1-pyrimidin-4-ylpiperidin-4-yl)methanamine
SMILESNCC1CCN(c2ccncn2)CC1
InChIInChI=1S/C10H16N4/c11-7-9-2-5-14(6-3-9)10-1-4-12-8-13-10/h1,4,8-9H,2-3,5-7,11H2
InChIKeySOQIYEUEAKMJCJ-UHFFFAOYSA-N
XLogP0.65
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-Pyrimidinyl)piperazine
CID 88747
N4-methyl-6-piperidin-1-yl-pyrimidine-2,4-diamine
CID 17773877
1-(2-Pyrimidyl)piperazine hydrochloride
CID 2818457
2,4-Diamino-6-piperidinopyrimidine
CID 606255
4-(Cyclohexylamino)pyrimidine-2-carbonitrile
CID 16108884
2-Piperazinylpyrimidine dihydrochloride
CID 11680272
N1-(4-(azepan-1-yl)pyrimidin-2-yl)ethane-1,2-diamine
CID 10198583
[4-(2-Dipropylamino-ethyl)-cyclohexyl]-pyrimidin-2-yl-amine
CID 10756932
4-(Piperazin-1-yl)pyrimidin-2-amine
CID 19969682
4-(4-Methylpiperazin-1-YL)pyrimidin-2-amine
CID 25128833
N-(3,3-dimethylbutyl)-6-(4-methylpiperazin-1-yl)pyrimidin-4-amine
CID 54754351
N-(3,3-dimethylbutyl)-6-(piperazin-1-yl)pyrimidin-4-amine
CID 57394628

Frequently Asked Questions

What is the IUPAC name of (1-pyrimidin-4-ylpiperidin-4-yl)methanamine?
The IUPAC name of (1-pyrimidin-4-ylpiperidin-4-yl)methanamine (CID 22052431) is (1-pyrimidin-4-ylpiperidin-4-yl)methanamine.
What is the SMILES notation for (1-pyrimidin-4-ylpiperidin-4-yl)methanamine?
The canonical SMILES for (1-pyrimidin-4-ylpiperidin-4-yl)methanamine is NCC1CCN(c2ccncn2)CC1.
What is the InChIKey of (1-pyrimidin-4-ylpiperidin-4-yl)methanamine?
The InChIKey is SOQIYEUEAKMJCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c11-7-9-2-5-14(6-3-9)10-1-4-12-8-13-10/h1,4,8-9H,2-3,5-7,11H2.
What are the key properties of (1-pyrimidin-4-ylpiperidin-4-yl)methanamine?
(1-pyrimidin-4-ylpiperidin-4-yl)methanamine has a molecular weight of 192.27 g/mol, XLogP of 0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-pyrimidin-4-ylpiperidin-4-yl)methanamine is sourced from PubChem (CID 22052431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).