3-methylidene-N,6-dipropylnonan-5-amine

C16H33N — CID 105005823

IUPAC3-methylidene-N,6-dipropylnonan-5-amine
SMILESC=C(CC)CC(NCCC)C(CCC)CCC
InChIInChI=1S/C16H33N/c1-6-10-15(11-7-2)16(17-12-8-3)13-14(5)9-4/h15-17H,5-13H2,1-4H3
InChIKeyUSBLCQPRTOOFJP-UHFFFAOYSA-N
MW239.45 g/mol
LogP4.93
Rot. Bonds11

About 3-methylidene-N,6-dipropylnonan-5-amine

3-methylidene-N,6-dipropylnonan-5-amine (PubChem CID 105005823) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is 3-methylidene-N,6-dipropylnonan-5-amine.

Molecular Properties

Compound Name3-methylidene-N,6-dipropylnonan-5-amine
PubChem CID105005823
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC Name3-methylidene-N,6-dipropylnonan-5-amine
SMILESC=C(CC)CC(NCCC)C(CCC)CCC
InChIInChI=1S/C16H33N/c1-6-10-15(11-7-2)16(17-12-8-3)13-14(5)9-4/h15-17H,5-13H2,1-4H3
InChIKeyUSBLCQPRTOOFJP-UHFFFAOYSA-N
XLogP4.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.45
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1,1-trifluoro-5-methylidene-N-propyl-2-(trifluoromethyl)heptan-3-amine
CID 103312115
3-methylidene-6-propylnonan-5-amine
CID 105006117
1-cyclopropyl-1-methoxy-4-methylidene-N-propylhexan-2-amine
CID 116722865
5-ethyl-2-methyl-N-propylhept-1-en-4-amine
CID 105004318
N-methyl-6-methylideneoctan-4-amine
CID 66044817
N,6-dipropylnon-1-en-5-amine
CID 104987362
5-methylidene-1-methylsulfanyl-N-propylheptan-3-amine
CID 105163897
N,4-dipropyldodecan-5-amine
CID 115832095
1-methoxy-4-methylidene-1-phenyl-N-propylhexan-2-amine
CID 116773267
1-ethoxy-6-methylidene-N-propyloctan-4-amine
CID 105164104
N,4-dipropyldodec-11-en-5-amine
CID 107011617
3-ethyl-3-N,3-N-dimethyl-6-methylidene-4-N-propyloctane-3,4-diamine
CID 79062183

Frequently Asked Questions

What is the IUPAC name of 3-methylidene-N,6-dipropylnonan-5-amine?
The IUPAC name of 3-methylidene-N,6-dipropylnonan-5-amine (CID 105005823) is 3-methylidene-N,6-dipropylnonan-5-amine.
What is the SMILES notation for 3-methylidene-N,6-dipropylnonan-5-amine?
The canonical SMILES for 3-methylidene-N,6-dipropylnonan-5-amine is C=C(CC)CC(NCCC)C(CCC)CCC.
What is the InChIKey of 3-methylidene-N,6-dipropylnonan-5-amine?
The InChIKey is USBLCQPRTOOFJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-6-10-15(11-7-2)16(17-12-8-3)13-14(5)9-4/h15-17H,5-13H2,1-4H3.
What are the key properties of 3-methylidene-N,6-dipropylnonan-5-amine?
3-methylidene-N,6-dipropylnonan-5-amine has a molecular weight of 239.45 g/mol, XLogP of 4.93, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-N,6-dipropylnonan-5-amine is sourced from PubChem (CID 105005823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).