(Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine

C10H18N4 — CID 143882858

IUPAC(Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine
SMILESCCN/C=C(\N)CCCc1cnc[nH]1
InChIInChI=1S/C10H18N4/c1-2-12-6-9(11)4-3-5-10-7-13-8-14-10/h6-8,12H,2-5,11H2,1H3,(H,13,14)/b9-6-
InChIKeyPKZOTEHAYVHVCO-TWGQIWQCSA-N
MW194.28 g/mol
LogP1.14
Rot. Bonds6

About (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine

(Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine (PubChem CID 143882858) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine.

Molecular Properties

Compound Name(Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine
PubChem CID143882858
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name(Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine
SMILESCCN/C=C(\N)CCCc1cnc[nH]1
InChIInChI=1S/C10H18N4/c1-2-12-6-9(11)4-3-5-10-7-13-8-14-10/h6-8,12H,2-5,11H2,1H3,(H,13,14)/b9-6-
InChIKeyPKZOTEHAYVHVCO-TWGQIWQCSA-N
XLogP1.14
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine;N-(3-phenylpropyl)formamide
CID 143882857
5-hexyl-1H-imidazole
CID 14225142
1-[3-(1H-imidazol-5-yl)propyl]-2-methylguanidine
CID 13499387
3-(1H-imidazol-5-yl)-N-methylpropan-1-amine
CID 19776442
4-(1H-imidazol-5-yl)butan-1-amine
CID 13499360
10-(1H-imidazol-5-yl)decan-2-one
CID 170211337
methyl 6-(1H-imidazol-5-yl)hexanoate
CID 151564733
N-[2-(1H-imidazol-5-yl)ethyl]heptanamide
CID 14712098
N-[2-(1H-imidazol-5-yl)ethyl]hexadecanamide
CID 171117218
1-[3-(1H-imidazol-5-yl)propyl]-3-propylthiourea
CID 10398801
1,2-bis[3-(1H-imidazol-5-yl)propyl]guanidine
CID 13499378
2-(1H-imidazol-5-yl)ethylurea
CID 10582986

Frequently Asked Questions

What is the IUPAC name of (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine?
The IUPAC name of (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine (CID 143882858) is (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine.
What is the SMILES notation for (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine?
The canonical SMILES for (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine is CCN/C=C(\N)CCCc1cnc[nH]1.
What is the InChIKey of (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine?
The InChIKey is PKZOTEHAYVHVCO-TWGQIWQCSA-N. The full InChI is InChI=1S/C10H18N4/c1-2-12-6-9(11)4-3-5-10-7-13-8-14-10/h6-8,12H,2-5,11H2,1H3,(H,13,14)/b9-6-.
What are the key properties of (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine?
(Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine has a molecular weight of 194.28 g/mol, XLogP of 1.14, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-N-ethyl-5-(1H-imidazol-5-yl)pent-1-ene-1,2-diamine is sourced from PubChem (CID 143882858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).