1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine

C10H18N4 — CID 150810950

IUPAC1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine
SMILESNC1CCN(CN2C=CC=NC2)CC1
InChIInChI=1S/C10H18N4/c11-10-2-6-13(7-3-10)9-14-5-1-4-12-8-14/h1,4-5,10H,2-3,6-9,11H2
InChIKeyKHWOSFDMDCUBPX-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.22
Rot. Bonds2

About 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine

1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine (PubChem CID 150810950) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine
PubChem CID150810950
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine
SMILESNC1CCN(CN2C=CC=NC2)CC1
InChIInChI=1S/C10H18N4/c11-10-2-6-13(7-3-10)9-14-5-1-4-12-8-14/h1,4-5,10H,2-3,6-9,11H2
InChIKeyKHWOSFDMDCUBPX-UHFFFAOYSA-N
XLogP0.22
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-piperidin-4-yl-2H-pyrimidin-2-amine
CID 66896745
6-methyl-2-piperidin-1-yl-1H-pyrimidin-2-amine
CID 68004596
1,2-Dihydropyrimidine;piperidine
CID 69489554
N-piperidin-4-yl-1,2-dihydropyrazin-5-amine
CID 89149707
(Z)-3-(1-methylpiperidin-4-yl)iminoprop-1-en-1-amine
CID 143782130
2-(1-methylpiperidin-2-yl)-1H-pyrimidin-2-amine
CID 151210795
2-butyl-2-N,6-N-dimethyl-2-N-piperidin-4-yl-1H-pyrimidine-2,6-diamine
CID 152687444
3-(1-Methylpiperidin-4-yl)iminoprop-1-en-1-amine
CID 153153367
ethane;(Z)-3-(1-methylpiperidin-4-yl)iminoprop-1-en-1-amine
CID 153567217
6-N,2-dimethyl-2-N-piperidin-4-yl-1H-pyrimidine-2,6-diamine
CID 153898680
2-butyl-6-N,6-N-dimethyl-2-N-piperidin-4-yl-1H-pyrimidine-2,6-diamine
CID 153898681
2-methyl-2-N-piperidin-4-yl-6-N,6-N-dipropyl-1H-pyrimidine-2,6-diamine
CID 153898683

Frequently Asked Questions

What is the IUPAC name of 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine?
The IUPAC name of 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine (CID 150810950) is 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine.
What is the SMILES notation for 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine?
The canonical SMILES for 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine is NC1CCN(CN2C=CC=NC2)CC1.
What is the InChIKey of 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine?
The InChIKey is KHWOSFDMDCUBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c11-10-2-6-13(7-3-10)9-14-5-1-4-12-8-14/h1,4-5,10H,2-3,6-9,11H2.
What are the key properties of 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine?
1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine has a molecular weight of 194.28 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2H-pyrimidin-1-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 150810950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).