N,N-bis(prop-2-enyl)undecan-1-amine

C17H33N — CID 10156078

IUPACN,N-bis(prop-2-enyl)undecan-1-amine
SMILESC=CCN(CC=C)CCCCCCCCCCC
InChIInChI=1S/C17H33N/c1-4-7-8-9-10-11-12-13-14-17-18(15-5-2)16-6-3/h5-6H,2-4,7-17H2,1H3
InChIKeyDWCJKORELWLSIP-UHFFFAOYSA-N
MW251.46 g/mol
LogP5.19
Rot. Bonds14

About N,N-bis(prop-2-enyl)undecan-1-amine

N,N-bis(prop-2-enyl)undecan-1-amine (PubChem CID 10156078) has the molecular formula C17H33N and a molecular weight of 251.46 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)undecan-1-amine.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)undecan-1-amine
PubChem CID10156078
Molecular FormulaC17H33N
Molecular Weight251.46 g/mol
Exact Mass251.26
IUPAC NameN,N-bis(prop-2-enyl)undecan-1-amine
SMILESC=CCN(CC=C)CCCCCCCCCCC
InChIInChI=1S/C17H33N/c1-4-7-8-9-10-11-12-13-14-17-18(15-5-2)16-6-3/h5-6H,2-4,7-17H2,1H3
InChIKeyDWCJKORELWLSIP-UHFFFAOYSA-N
XLogP5.19
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500251.46
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-bis(prop-2-enyl)octadecan-1-amine;hydrochloride
CID 88725807
N,N-bis(prop-2-enyl)hexadecan-1-amine;N-prop-2-enylprop-2-en-1-amine
CID 174680920
2-[pentyl(prop-2-enyl)amino]ethanol
CID 115623581
N-methyl-N-prop-2-enylhexadecan-1-amine
CID 100953658
N-methyl-N-prop-2-enyloctadecan-1-amine;hydrochloride
CID 173181442
N-benzyl-N-prop-2-enyldodecan-1-amine
CID 67899805
N',N'-bis(prop-2-enyl)-N-propylbutane-1,4-diamine
CID 62437868
ethyl 2-[hexyl(prop-2-enyl)amino]acetate
CID 79002539
N,N-dipentyltridecan-1-amine
CID 139723521
N,N'-didodecyl-N,N'-dioctylhexane-1,6-diamine
CID 154294870
N,N-dipentylpentadecan-1-amine
CID 139722952
N,N-didodecyltridecan-1-amine
CID 87212898

Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)undecan-1-amine?
The IUPAC name of N,N-bis(prop-2-enyl)undecan-1-amine (CID 10156078) is N,N-bis(prop-2-enyl)undecan-1-amine.
What is the SMILES notation for N,N-bis(prop-2-enyl)undecan-1-amine?
The canonical SMILES for N,N-bis(prop-2-enyl)undecan-1-amine is C=CCN(CC=C)CCCCCCCCCCC.
What is the InChIKey of N,N-bis(prop-2-enyl)undecan-1-amine?
The InChIKey is DWCJKORELWLSIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N/c1-4-7-8-9-10-11-12-13-14-17-18(15-5-2)16-6-3/h5-6H,2-4,7-17H2,1H3.
What are the key properties of N,N-bis(prop-2-enyl)undecan-1-amine?
N,N-bis(prop-2-enyl)undecan-1-amine has a molecular weight of 251.46 g/mol, XLogP of 5.19, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)undecan-1-amine is sourced from PubChem (CID 10156078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).