2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine

C9H19NO — CID 134219975

IUPAC2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine
SMILESCCC/C=C\ONC(C)(C)C
InChIInChI=1S/C9H19NO/c1-5-6-7-8-11-10-9(2,3)4/h7-8,10H,5-6H2,1-4H3/b8-7-
InChIKeyFXCSDNVHAOFAOI-FPLPWBNLSA-N
MW157.26 g/mol
LogP2.62
Rot. Bonds4

About 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine

2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine (PubChem CID 134219975) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine
PubChem CID134219975
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine
SMILESCCC/C=C\ONC(C)(C)C
InChIInChI=1S/C9H19NO/c1-5-6-7-8-11-10-9(2,3)4/h7-8,10H,5-6H2,1-4H3/b8-7-
InChIKeyFXCSDNVHAOFAOI-FPLPWBNLSA-N
XLogP2.62
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(Z)-1-ethoxypent-1-ene
CID 12512190
trihydroxy(pent-1-enoxy)silane
CID 154089846
(E)-1-[(Z)-but-1-enoxy]pent-1-ene
CID 173340391
(E)-2,2-dimethylhept-3-ene
CID 5352650
(4Z,8E)-dodeca-4,8-diene
CID 12576906
(4E,8E)-dodeca-4,8-diene
CID 12576905
ethane;(E)-oct-4-ene
CID 142055407
2-methylhept-3-en-2-yloxysilane
CID 173198643
pent-1-enyl methanesulfonate
CID 86627662
pent-1-enyl carbonobromidate
CID 141324440
(E)-N-tert-butyl-2-oxohept-3-enamide
CID 56659565
but-2-ene;hex-2-ene;oct-4-ene;ruthenium
CID 161087465

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine?
The IUPAC name of 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine (CID 134219975) is 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine is CCC/C=C\ONC(C)(C)C.
What is the InChIKey of 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine?
The InChIKey is FXCSDNVHAOFAOI-FPLPWBNLSA-N. The full InChI is InChI=1S/C9H19NO/c1-5-6-7-8-11-10-9(2,3)4/h7-8,10H,5-6H2,1-4H3/b8-7-.
What are the key properties of 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine?
2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine has a molecular weight of 157.26 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(Z)-pent-1-enoxy]propan-2-amine is sourced from PubChem (CID 134219975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).