N-(1-cyclopropylidenepropyl)but-3-en-2-imine

C10H15N — CID 123763533

IUPACN-(1-cyclopropylidenepropyl)but-3-en-2-imine
SMILESC=C/C(C)=N/C(CC)=C1CC1
InChIInChI=1S/C10H15N/c1-4-8(3)11-10(5-2)9-6-7-9/h4H,1,5-7H2,2-3H3/b11-8+
InChIKeyMFLIWFIOTAKQRN-DHZHZOJOSA-N
MW149.24 g/mol
LogP3.09
Rot. Bonds3

About N-(1-cyclopropylidenepropyl)but-3-en-2-imine

N-(1-cyclopropylidenepropyl)but-3-en-2-imine (PubChem CID 123763533) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is N-(1-cyclopropylidenepropyl)but-3-en-2-imine.

Molecular Properties

Compound NameN-(1-cyclopropylidenepropyl)but-3-en-2-imine
PubChem CID123763533
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC NameN-(1-cyclopropylidenepropyl)but-3-en-2-imine
SMILESC=C/C(C)=N/C(CC)=C1CC1
InChIInChI=1S/C10H15N/c1-4-8(3)11-10(5-2)9-6-7-9/h4H,1,5-7H2,2-3H3/b11-8+
InChIKeyMFLIWFIOTAKQRN-DHZHZOJOSA-N
XLogP3.09
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(3Z)-4-methyl-N-prop-1-en-2-ylhexa-3,5-dien-2-imine
CID 88576597
N-(3-methylbut-2-en-2-yl)but-3-en-2-imine
CID 88973763
N-[(Z)-5-methyloct-4-en-4-yl]but-3-en-2-imine
CID 89258689
4-methyl-N-prop-1-en-2-ylpent-3-en-2-imine
CID 89299679
(E)-3-methyl-N-prop-1-en-2-ylpent-3-en-2-imine
CID 117923561
N-(1-cyclopropylideneethyl)butan-2-imine
CID 123591135
N-(1-cyclopropylideneethyl)but-3-en-2-imine
CID 123957758
N-[(Z)-4,4-dimethylpent-2-en-3-yl]but-3-en-2-imine
CID 131966137
4-methyl-N-[(E)-3-methylpent-2-en-2-yl]pent-3-en-2-imine
CID 138569674
(Z)-3-methyl-N-prop-1-en-2-ylpent-3-en-2-imine
CID 142024841
ethane;N-(3-methylbut-2-en-2-yl)but-3-en-2-imine
CID 145365393
(3Z,5Z)-N-(3-methylbut-2-en-2-yl)hepta-3,5-dien-2-imine
CID 153622520

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylidenepropyl)but-3-en-2-imine?
The IUPAC name of N-(1-cyclopropylidenepropyl)but-3-en-2-imine (CID 123763533) is N-(1-cyclopropylidenepropyl)but-3-en-2-imine.
What is the SMILES notation for N-(1-cyclopropylidenepropyl)but-3-en-2-imine?
The canonical SMILES for N-(1-cyclopropylidenepropyl)but-3-en-2-imine is C=C/C(C)=N/C(CC)=C1CC1.
What is the InChIKey of N-(1-cyclopropylidenepropyl)but-3-en-2-imine?
The InChIKey is MFLIWFIOTAKQRN-DHZHZOJOSA-N. The full InChI is InChI=1S/C10H15N/c1-4-8(3)11-10(5-2)9-6-7-9/h4H,1,5-7H2,2-3H3/b11-8+.
What are the key properties of N-(1-cyclopropylidenepropyl)but-3-en-2-imine?
N-(1-cyclopropylidenepropyl)but-3-en-2-imine has a molecular weight of 149.24 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylidenepropyl)but-3-en-2-imine is sourced from PubChem (CID 123763533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).