N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine

C9H16N2 — CID 143115331

IUPACN-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine
SMILESC=C/C(CCNC)=N\C=C/C
InChIInChI=1S/C9H16N2/c1-4-7-11-9(5-2)6-8-10-3/h4-5,7,10H,2,6,8H2,1,3H3/b7-4-,11-9+
InChIKeyBLKNBIVLUXTVSE-RGSRAZRCSA-N
MW152.24 g/mol
LogP1.76
Rot. Bonds5

About N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine

N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine (PubChem CID 143115331) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine.

Molecular Properties

Compound NameN-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine
PubChem CID143115331
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC NameN-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine
SMILESC=C/C(CCNC)=N\C=C/C
InChIInChI=1S/C9H16N2/c1-4-7-11-9(5-2)6-8-10-3/h4-5,7,10H,2,6,8H2,1,3H3/b7-4-,11-9+
InChIKeyBLKNBIVLUXTVSE-RGSRAZRCSA-N
XLogP1.76
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(but-3-en-2-ylideneamino)-N-propylbutan-1-amine
CID 54075907
2,3-dihydro-1H-pyridin-1-ium-4-imine
CID 57146957
N-methyl-1-(3H-pyrrol-2-yl)methanamine
CID 58168955
(1S)-N-methyl-1-(3H-pyrrol-2-yl)ethanamine
CID 58427185
(1R)-N-methyl-1-(3H-pyrrol-2-yl)ethanamine
CID 58427201
(Z)-1-(pent-1-en-3-ylideneamino)prop-1-en-2-amine
CID 88987029
2-ethenylimino-N-propan-2-ylbut-3-en-1-amine
CID 89129347
3-ethylimino-N-methylpent-1-en-2-amine
CID 117852698
N-methyl-2-[(E)-3-(methylamino)prop-1-enyl]iminobut-3-en-1-amine
CID 122522672
1-N,2-N-dimethyl-3-methyliminopent-4-ene-1,2-diamine
CID 123196625
N-methyl-4-methyliminohex-5-en-3-amine
CID 123612125
N-methyl-2-[(Z)-pent-1-enyl]iminopropan-1-amine
CID 126762207

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine?
The IUPAC name of N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine (CID 143115331) is N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine.
What is the SMILES notation for N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine?
The canonical SMILES for N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine is C=C/C(CCNC)=N\C=C/C.
What is the InChIKey of N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine?
The InChIKey is BLKNBIVLUXTVSE-RGSRAZRCSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-7-11-9(5-2)6-8-10-3/h4-5,7,10H,2,6,8H2,1,3H3/b7-4-,11-9+.
What are the key properties of N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine?
N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine has a molecular weight of 152.24 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[(Z)-prop-1-enyl]iminopent-4-en-1-amine is sourced from PubChem (CID 143115331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).