(2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine

C14H20N2 — CID 156543983

IUPAC(2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine
SMILESC=CN1C(/C=C\C)=C(/C=C\C)C(N)/C1=C/C
InChIInChI=1S/C14H20N2/c1-5-9-11-13(10-6-2)16(8-4)12(7-3)14(11)15/h5-10,14H,4,15H2,1-3H3/b9-5-,10-6-,12-7-
InChIKeyHTXAOBAELSCMDX-RUHZRYRMSA-N
MW216.33 g/mol
LogP3.08
Rot. Bonds3

About (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine

(2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine (PubChem CID 156543983) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine.

Molecular Properties

Compound Name(2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine
PubChem CID156543983
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name(2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine
SMILESC=CN1C(/C=C\C)=C(/C=C\C)C(N)/C1=C/C
InChIInChI=1S/C14H20N2/c1-5-9-11-13(10-6-2)16(8-4)12(7-3)14(11)15/h5-10,14H,4,15H2,1-3H3/b9-5-,10-6-,12-7-
InChIKeyHTXAOBAELSCMDX-RUHZRYRMSA-N
XLogP3.08
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(2-fluorobut-2-enylidene)-4-methylidene-1H-pyrrol-3-yl]-N,N-dimethylmethanamine
CID 123887050
(3E)-2-N-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1-N-methylhexa-3,5-diene-1,2-diamine
CID 156191967
(3R,4E)-3-N-(2,2-difluoroethyl)-4-ethenyl-3-N-propan-2-ylhexa-1,4-diene-2,3-diamine
CID 170727886
1,6-ditert-butyl-3,7-dihydro-2H-pyrrolo[2,3-c]pyridine
CID 20773197
4-[(4-Ethylpiperazin-1-yl)methyl]cyclopenta-1,3-dien-1-amine
CID 58111088
N-methyl-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethenamine
CID 59334807
1-Methyl-2,3,4,9a-tetrahydro-1,4-benzodiazepin-8-amine
CID 67264034
N-(cyclohexa-1,3-dien-1-ylmethyl)-N-[[(2R)-5-methylidenepyrrolidin-2-yl]methyl]ethanamine
CID 68019176
(Z)-2-(5-ethenyl-2-methyl-2,3-dihydro-1H-pyrrol-4-yl)ethenamine
CID 68248182
(Z)-1-(4-ethenyl-1-methyl-2,3-dihydropyrrol-5-yl)prop-1-en-2-amine
CID 68396239
7-N,7-N,3-trimethyl-1,2,4,8-tetrahydro-3-benzazepine-7,8-diamine
CID 69697800
1-Methyl-2,3,4,8-tetrahydropyrido[3,4-b]azepine
CID 69986763

Frequently Asked Questions

What is the IUPAC name of (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine?
The IUPAC name of (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine (CID 156543983) is (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine.
What is the SMILES notation for (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine?
The canonical SMILES for (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine is C=CN1C(/C=C\C)=C(/C=C\C)C(N)/C1=C/C.
What is the InChIKey of (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine?
The InChIKey is HTXAOBAELSCMDX-RUHZRYRMSA-N. The full InChI is InChI=1S/C14H20N2/c1-5-9-11-13(10-6-2)16(8-4)12(7-3)14(11)15/h5-10,14H,4,15H2,1-3H3/b9-5-,10-6-,12-7-.
What are the key properties of (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine?
(2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine has a molecular weight of 216.33 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-1-ethenyl-2-ethylidene-4,5-bis[(Z)-prop-1-enyl]-3H-pyrrol-3-amine is sourced from PubChem (CID 156543983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).