(E)-1-nitrosopent-1-ene

C5H9NO — CID 148875645

IUPAC(E)-1-nitrosopent-1-ene
SMILESCCC/C=C/N=O
InChIInChI=1S/C5H9NO/c1-2-3-4-5-6-7/h4-5H,2-3H2,1H3/b5-4+
InChIKeyPCAXMKOJAARUMA-SNAWJCMRSA-N
MW99.13 g/mol
LogP2.07
Rot. Bonds3

About (E)-1-nitrosopent-1-ene

(E)-1-nitrosopent-1-ene (PubChem CID 148875645) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is (E)-1-nitrosopent-1-ene.

Molecular Properties

Compound Name(E)-1-nitrosopent-1-ene
PubChem CID148875645
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC Name(E)-1-nitrosopent-1-ene
SMILESCCC/C=C/N=O
InChIInChI=1S/C5H9NO/c1-2-3-4-5-6-7/h4-5H,2-3H2,1H3/b5-4+
InChIKeyPCAXMKOJAARUMA-SNAWJCMRSA-N
XLogP2.07
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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(4Z,8E)-dodeca-4,8-diene
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ethane;(E)-oct-4-ene
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(4E,8E)-dodeca-4,8-diene
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N-ethyl-N'-[(E)-pent-1-enyl]ethane-1,2-diimine
CID 123367431
N-undeca-1,4,7-trienyliminonitrous amide
CID 90698164
[(E)-hex-2-enyl]phosphane
CID 88550946
(Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine
CID 163673678
pent-1-enylphosphonic acid
CID 54140925
(E)-hex-2-en-1-ol;hydrochloride
CID 141009996
(E)-hex-2-enal
CID 158800846
(4Z,7Z,10Z,13Z)-heptadeca-4,7,10,13-tetraene
CID 10473036

Frequently Asked Questions

What is the IUPAC name of (E)-1-nitrosopent-1-ene?
The IUPAC name of (E)-1-nitrosopent-1-ene (CID 148875645) is (E)-1-nitrosopent-1-ene.
What is the SMILES notation for (E)-1-nitrosopent-1-ene?
The canonical SMILES for (E)-1-nitrosopent-1-ene is CCC/C=C/N=O.
What is the InChIKey of (E)-1-nitrosopent-1-ene?
The InChIKey is PCAXMKOJAARUMA-SNAWJCMRSA-N. The full InChI is InChI=1S/C5H9NO/c1-2-3-4-5-6-7/h4-5H,2-3H2,1H3/b5-4+.
What are the key properties of (E)-1-nitrosopent-1-ene?
(E)-1-nitrosopent-1-ene has a molecular weight of 99.13 g/mol, XLogP of 2.07, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-nitrosopent-1-ene is sourced from PubChem (CID 148875645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).