6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine

C15H24N4 — CID 172616648

IUPAC6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine
SMILESC=C1NC=NC(N2CCNCC2)=C1/C=C\C(C)CC
InChIInChI=1S/C15H24N4/c1-4-12(2)5-6-14-13(3)17-11-18-15(14)19-9-7-16-8-10-19/h5-6,11-12,16H,3-4,7-10H2,1-2H3,(H,17,18)/b6-5-
InChIKeyUFGBWEBGWDJWFE-WAYWQWQTSA-N
MW260.39 g/mol
LogP1.85
Rot. Bonds4

About 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine

6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine (PubChem CID 172616648) has the molecular formula C15H24N4 and a molecular weight of 260.39 g/mol. Its IUPAC name is 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine.

Molecular Properties

Compound Name6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine
PubChem CID172616648
Molecular FormulaC15H24N4
Molecular Weight260.39 g/mol
Exact Mass260.20
IUPAC Name6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine
SMILESC=C1NC=NC(N2CCNCC2)=C1/C=C\C(C)CC
InChIInChI=1S/C15H24N4/c1-4-12(2)5-6-14-13(3)17-11-18-15(14)19-9-7-16-8-10-19/h5-6,11-12,16H,3-4,7-10H2,1-2H3,(H,17,18)/b6-5-
InChIKeyUFGBWEBGWDJWFE-WAYWQWQTSA-N
XLogP1.85
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.39
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[amino-[(2-fluoro-6-methylcyclohexa-1,3-dien-1-yl)amino]methylidene]-4-methylpiperazine-1-carboximidamide
CID 176530266
(NZ)-N-(aminomethylidene)-N'-[(6-methylidene-2,3-dihydro-1H-pyridin-4-yl)methyl]piperazine-1-carboximidamide;ethane
CID 141771425
(3E)-5-[4-[(4-methylcyclohexa-1,5-dien-1-yl)methyl]piperazin-1-yl]-5-methyliminopenta-1,3-dien-3-amine
CID 142085184
ethane;N-[(1E,3Z,5Z,7E)-8-ethylcycloocta-1,3,5,7-tetraen-1-yl]-N'-methyl-2-propan-2-ylpiperazine-1-carboximidamide
CID 143604854
N'-[3-(1,6-dimethylidene-3,4-dihydro-2H-pyrido[1,2-a]pyrazin-7-yl)prop-1-en-2-yl]-N-methylidenemethanimidamide;ethane
CID 155571299
1-(3-Amino-6-methylcyclohexa-2,4-dien-1-yl)-2-methylguanidine
CID 163464507
1-(2-Methylpropyl)-5,5a-dihydroimidazo[4,5-c]quinolin-4-amine
CID 169024403
4-(1,4,4a,8a-tetrahydroquinoxalin-2-yl)-N'-methanimidoyl-N-(5-methylcyclohexa-1,3-dien-1-yl)-2-propan-2-ylpiperazine-1-carboximidamide
CID 176539405
(NZ)-N-(aminomethylidene)-N'-[(6-methylidene-2,3-dihydro-1H-pyridin-4-yl)methyl]piperazine-1-carboximidamide
CID 141771426
N-(2-ethylcycloocta-1,3,5,7-tetraen-1-yl)-N'-methyl-2-propan-2-ylpiperazine-1-carboximidamide
CID 143604855
N'-[3-(1,6-dimethylidene-3,4-dihydro-2H-pyrido[1,2-a]pyrazin-7-yl)prop-1-en-2-yl]-N-methylidenemethanimidamide
CID 155571300

Frequently Asked Questions

What is the IUPAC name of 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine?
The IUPAC name of 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine (CID 172616648) is 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine.
What is the SMILES notation for 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine?
The canonical SMILES for 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine is C=C1NC=NC(N2CCNCC2)=C1/C=C\C(C)CC.
What is the InChIKey of 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine?
The InChIKey is UFGBWEBGWDJWFE-WAYWQWQTSA-N. The full InChI is InChI=1S/C15H24N4/c1-4-12(2)5-6-14-13(3)17-11-18-15(14)19-9-7-16-8-10-19/h5-6,11-12,16H,3-4,7-10H2,1-2H3,(H,17,18)/b6-5-.
What are the key properties of 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine?
6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine has a molecular weight of 260.39 g/mol, XLogP of 1.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-5-[(Z)-3-methylpent-1-enyl]-4-piperazin-1-yl-1H-pyrimidine is sourced from PubChem (CID 172616648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).