N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine

C14H25N5 — CID 112858075

IUPACN,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine
SMILESCCN1CCN(c2cc(N(CC)CC)ncn2)CC1
InChIInChI=1S/C14H25N5/c1-4-17-7-9-19(10-8-17)14-11-13(15-12-16-14)18(5-2)6-3/h11-12H,4-10H2,1-3H3
InChIKeyYTFHPLACZIGKRK-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.46
Rot. Bonds5

About N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine

N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine (PubChem CID 112858075) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine
PubChem CID112858075
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC NameN,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine
SMILESCCN1CCN(c2cc(N(CC)CC)ncn2)CC1
InChIInChI=1S/C14H25N5/c1-4-17-7-9-19(10-8-17)14-11-13(15-12-16-14)18(5-2)6-3/h11-12H,4-10H2,1-3H3
InChIKeyYTFHPLACZIGKRK-UHFFFAOYSA-N
XLogP1.46
TPSA35.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-benzylpiperazin-1-yl)-N,N-diethylpyrimidin-4-amine
CID 112862165
4-[6-(diethylamino)pyrimidin-4-yl]piperazine-1-carbaldehyde
CID 112858251
1-ethyl-4-[6-(4-ethyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-1,4-diazepane
CID 166231873
N-benzyl-N-ethyl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 112855661
N,N-dipropyl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 112855707
2-[4-[6-[ethyl(methyl)amino]pyrimidin-4-yl]piperazin-1-yl]ethanol
CID 115265221
[1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
CID 66570083
[(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
CID 86331729
6-[(3R)-3-aminopiperidin-1-yl]-N,N-diethylpyrimidin-4-amine
CID 86318094
N-(1,1-dioxothiolan-3-yl)-6-(4-ethylpiperazin-1-yl)-N-methylpyrimidin-4-amine
CID 112858053
4-(4-ethylpiperazin-1-yl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine
CID 112858073
1-[6-(diethylamino)pyrimidin-4-yl]piperidine-3-carboxylic acid
CID 66570081

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine?
The IUPAC name of N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine (CID 112858075) is N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine.
What is the SMILES notation for N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine?
The canonical SMILES for N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine is CCN1CCN(c2cc(N(CC)CC)ncn2)CC1.
What is the InChIKey of N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine?
The InChIKey is YTFHPLACZIGKRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-4-17-7-9-19(10-8-17)14-11-13(15-12-16-14)18(5-2)6-3/h11-12H,4-10H2,1-3H3.
What are the key properties of N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine?
N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine has a molecular weight of 263.39 g/mol, XLogP of 1.46, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 112858075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).