(Z)-(4-methyliminopiperidin-3-ylidene)methanamine

C7H13N3 — CID 138571622

IUPAC(Z)-(4-methyliminopiperidin-3-ylidene)methanamine
SMILESC/N=C1\CCNC\C1=C\N
InChIInChI=1S/C7H13N3/c1-9-7-2-3-10-5-6(7)4-8/h4,10H,2-3,5,8H2,1H3/b6-4-,9-7+
InChIKeyQPDYEWPZBWYTBA-UNQQQNFISA-N
MW139.20 g/mol
LogP-0.11
Rot. Bonds

About (Z)-(4-methyliminopiperidin-3-ylidene)methanamine

(Z)-(4-methyliminopiperidin-3-ylidene)methanamine (PubChem CID 138571622) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is (Z)-(4-methyliminopiperidin-3-ylidene)methanamine.

Molecular Properties

Compound Name(Z)-(4-methyliminopiperidin-3-ylidene)methanamine
PubChem CID138571622
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name(Z)-(4-methyliminopiperidin-3-ylidene)methanamine
SMILESC/N=C1\CCNC\C1=C\N
InChIInChI=1S/C7H13N3/c1-9-7-2-3-10-5-6(7)4-8/h4,10H,2-3,5,8H2,1H3/b6-4-,9-7+
InChIKeyQPDYEWPZBWYTBA-UNQQQNFISA-N
XLogP-0.11
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[1-Methyl-4-(2,2,2-trifluoroethylimino)piperidin-3-ylidene]methanamine
CID 148303689
(1Z)-1-(4-iminopiperidin-3-ylidene)ethanamine
CID 88278220
3-Methylidenepiperidin-4-imine
CID 139423586
ethane;3-methyl-6,7,8,9-tetrahydro-4H-pyrido[4,3-b]azepine
CID 141929412
ethane;(Z)-(1-methyl-4-methyliminopiperidin-3-ylidene)methanamine
CID 142162029
ethane;(Z)-(1-methyl-4-methyliminopiperidin-3-ylidene)methanamine
CID 142162053
N-(2-methylprop-1-enyl)-1-piperidin-4-ylprop-2-en-1-imine
CID 143003964
2-methylidene-N-[(Z)-prop-1-enyl]piperidin-3-imine
CID 143498553
(3Z)-1-ethyl-3-[(methylideneamino)methylidene]piperidin-4-imine
CID 143866558
(3Z)-3-ethylidene-N-methylpiperidin-4-imine
CID 143890086
ethane;N-ethyl-1-(5-methyl-3,4-dihydropyridin-2-yl)ethenamine
CID 144086778
(4-Tert-butylimino-1-methylpiperidin-3-ylidene)methanamine
CID 144213705

Frequently Asked Questions

What is the IUPAC name of (Z)-(4-methyliminopiperidin-3-ylidene)methanamine?
The IUPAC name of (Z)-(4-methyliminopiperidin-3-ylidene)methanamine (CID 138571622) is (Z)-(4-methyliminopiperidin-3-ylidene)methanamine.
What is the SMILES notation for (Z)-(4-methyliminopiperidin-3-ylidene)methanamine?
The canonical SMILES for (Z)-(4-methyliminopiperidin-3-ylidene)methanamine is C/N=C1\CCNC\C1=C\N.
What is the InChIKey of (Z)-(4-methyliminopiperidin-3-ylidene)methanamine?
The InChIKey is QPDYEWPZBWYTBA-UNQQQNFISA-N. The full InChI is InChI=1S/C7H13N3/c1-9-7-2-3-10-5-6(7)4-8/h4,10H,2-3,5,8H2,1H3/b6-4-,9-7+.
What are the key properties of (Z)-(4-methyliminopiperidin-3-ylidene)methanamine?
(Z)-(4-methyliminopiperidin-3-ylidene)methanamine has a molecular weight of 139.20 g/mol, XLogP of -0.11, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-(4-methyliminopiperidin-3-ylidene)methanamine is sourced from PubChem (CID 138571622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).