[4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine

C15H26N4 — CID 103353715

IUPAC[4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine
SMILESCCC1CCN(c2cc(C(C)C)ncn2)C(CN)C1
InChIInChI=1S/C15H26N4/c1-4-12-5-6-19(13(7-12)9-16)15-8-14(11(2)3)17-10-18-15/h8,10-13H,4-7,9,16H2,1-3H3
InChIKeyDSONCTBHXARQSH-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.55
Rot. Bonds4

About [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine

[4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine (PubChem CID 103353715) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine.

Molecular Properties

Compound Name[4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine
PubChem CID103353715
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name[4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine
SMILESCCC1CCN(c2cc(C(C)C)ncn2)C(CN)C1
InChIInChI=1S/C15H26N4/c1-4-12-5-6-19(13(7-12)9-16)15-8-14(11(2)3)17-10-18-15/h8,10-13H,4-7,9,16H2,1-3H3
InChIKeyDSONCTBHXARQSH-UHFFFAOYSA-N
XLogP2.55
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-methoxy-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine
CID 112622870
[4-ethyl-1-(4-methyl-5-nitro-2-pyridinyl)piperidin-2-yl]methanamine
CID 103353516
[1-(5-tert-butyl-2-pyridinyl)-4-ethylpiperidin-2-yl]methanamine
CID 107875205
[4-methoxy-1-(6-methoxypyrimidin-4-yl)piperidin-2-yl]methanamine
CID 112622803
5-amino-4-[2-(aminomethyl)-4-ethylpiperidin-1-yl]-1H-pyrimidin-6-one
CID 136869158
2-methyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidine-4-carboxylic acid
CID 106742662
4-methyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidine-2-carboxylic acid
CID 114422399
3-[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]propanoic acid
CID 62216303
N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine
CID 62592540
(2S)-1-(6-propan-2-ylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 122059787
2-[2-(aminomethyl)-4-ethylpiperidin-1-yl]-5-nitropyridine-3-carbonitrile
CID 103353691
2-[2-(aminomethyl)-4-ethylpiperidin-1-yl]-4-chlorobenzonitrile
CID 103353808

Frequently Asked Questions

What is the IUPAC name of [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine?
The IUPAC name of [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine (CID 103353715) is [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine.
What is the SMILES notation for [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine?
The canonical SMILES for [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine is CCC1CCN(c2cc(C(C)C)ncn2)C(CN)C1.
What is the InChIKey of [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine?
The InChIKey is DSONCTBHXARQSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-12-5-6-19(13(7-12)9-16)15-8-14(11(2)3)17-10-18-15/h8,10-13H,4-7,9,16H2,1-3H3.
What are the key properties of [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine?
[4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine has a molecular weight of 262.40 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine is sourced from PubChem (CID 103353715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).