N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine

C14H28N2 — CID 143764002

IUPACN,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine
SMILESC/C=C\N=C(/C)CCC(CCCC)N(C)C
InChIInChI=1S/C14H28N2/c1-6-8-9-14(16(4)5)11-10-13(3)15-12-7-2/h7,12,14H,6,8-11H2,1-5H3/b12-7-,15-13+
InChIKeyDOXCOKCHAMYEJV-XSAPRFFASA-N
MW224.39 g/mol
LogP3.88
Rot. Bonds8

About N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine

N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine (PubChem CID 143764002) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine.

Molecular Properties

Compound NameN,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine
PubChem CID143764002
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine
SMILESC/C=C\N=C(/C)CCC(CCCC)N(C)C
InChIInChI=1S/C14H28N2/c1-6-8-9-14(16(4)5)11-10-13(3)15-12-7-2/h7,12,14H,6,8-11H2,1-5H3/b12-7-,15-13+
InChIKeyDOXCOKCHAMYEJV-XSAPRFFASA-N
XLogP3.88
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-methyl-N-[3-[(Z)-prop-1-enyl]iminobutyl]pentan-1-amine
CID 142257782
3-[(1Z)-buta-1,3-dienyl]imino-N,N-dimethylheptan-4-amine;ethane
CID 142371414
azane;ethylidene-octyl-[(Z)-prop-1-enyl]azanium
CID 159456107
3-ethyl-1-methyl-2-propyl-2H-pyrazine
CID 175223904
N-methyl-N-[3-[(Z)-prop-1-enyl]iminobutyl]pentan-1-amine
CID 142257783
3-[(1Z)-buta-1,3-dienyl]imino-N,N-dimethylheptan-4-amine
CID 142371415

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine?
The IUPAC name of N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine (CID 143764002) is N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine.
What is the SMILES notation for N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine?
The canonical SMILES for N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine is C/C=C\N=C(/C)CCC(CCCC)N(C)C.
What is the InChIKey of N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine?
The InChIKey is DOXCOKCHAMYEJV-XSAPRFFASA-N. The full InChI is InChI=1S/C14H28N2/c1-6-8-9-14(16(4)5)11-10-13(3)15-12-7-2/h7,12,14H,6,8-11H2,1-5H3/b12-7-,15-13+.
What are the key properties of N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine?
N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine has a molecular weight of 224.39 g/mol, XLogP of 3.88, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(Z)-prop-1-enyl]iminononan-5-amine is sourced from PubChem (CID 143764002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).