(E)-N-(3-methylbutyl)pent-2-en-2-amine

C10H21N — CID 87580789

IUPAC(E)-N-(3-methylbutyl)pent-2-en-2-amine
SMILESCC/C=C(\C)NCCC(C)C
InChIInChI=1S/C10H21N/c1-5-6-10(4)11-8-7-9(2)3/h6,9,11H,5,7-8H2,1-4H3/b10-6+
InChIKeyOXQCUSCSPKMSAK-UXBLZVDNSA-N
MW155.28 g/mol
LogP2.94
Rot. Bonds5

About (E)-N-(3-methylbutyl)pent-2-en-2-amine

(E)-N-(3-methylbutyl)pent-2-en-2-amine (PubChem CID 87580789) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (E)-N-(3-methylbutyl)pent-2-en-2-amine.

Molecular Properties

Compound Name(E)-N-(3-methylbutyl)pent-2-en-2-amine
PubChem CID87580789
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(E)-N-(3-methylbutyl)pent-2-en-2-amine
SMILESCC/C=C(\C)NCCC(C)C
InChIInChI=1S/C10H21N/c1-5-6-10(4)11-8-7-9(2)3/h6,9,11H,5,7-8H2,1-4H3/b10-6+
InChIKeyOXQCUSCSPKMSAK-UXBLZVDNSA-N
XLogP2.94
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-Dihydro-2,4-dihydro-2,4,6-tri-methylpyridine
CID 21326805
(Z)-N-(1-fluoroprop-2-enyl)-5-methylhex-2-en-2-amine
CID 130233741
(E,4R)-4-fluoro-N-(2-methylpropyl)hept-2-en-2-amine
CID 139324079
(Z)-1-fluoro-N-pent-4-enylpent-2-en-2-amine
CID 169814642
2-fluoro-3-methyl-N-(3-methylbut-1-en-2-yl)butan-1-amine
CID 170005371
1,2,4,4-Tetramethylpyrrolinium iodide
CID 129780456
2-n-Propyl-4-ethylpyrroline
CID 129804295
2-n-Propyl-4-methylpyrroline
CID 129804360
2-n-Propyl-5-ethylpyrroline
CID 129878460
(E)-N-ethyl-4-methylpent-2-en-3-amine
CID 17800491
N-butyl-3-methylpent-1-en-2-amine
CID 18717521
2,3,5-trimethyl-2,3-dihydro-1H-pyrrole
CID 20709743

Frequently Asked Questions

What is the IUPAC name of (E)-N-(3-methylbutyl)pent-2-en-2-amine?
The IUPAC name of (E)-N-(3-methylbutyl)pent-2-en-2-amine (CID 87580789) is (E)-N-(3-methylbutyl)pent-2-en-2-amine.
What is the SMILES notation for (E)-N-(3-methylbutyl)pent-2-en-2-amine?
The canonical SMILES for (E)-N-(3-methylbutyl)pent-2-en-2-amine is CC/C=C(\C)NCCC(C)C.
What is the InChIKey of (E)-N-(3-methylbutyl)pent-2-en-2-amine?
The InChIKey is OXQCUSCSPKMSAK-UXBLZVDNSA-N. The full InChI is InChI=1S/C10H21N/c1-5-6-10(4)11-8-7-9(2)3/h6,9,11H,5,7-8H2,1-4H3/b10-6+.
What are the key properties of (E)-N-(3-methylbutyl)pent-2-en-2-amine?
(E)-N-(3-methylbutyl)pent-2-en-2-amine has a molecular weight of 155.28 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(3-methylbutyl)pent-2-en-2-amine is sourced from PubChem (CID 87580789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).