9-methyl-N-propan-2-yldec-7-yn-1-amine

C14H27N — CID 170673540

IUPAC9-methyl-N-propan-2-yldec-7-yn-1-amine
SMILESCC(C)C#CCCCCCCNC(C)C
InChIInChI=1S/C14H27N/c1-13(2)11-9-7-5-6-8-10-12-15-14(3)4/h13-15H,5-8,10,12H2,1-4H3
InChIKeyFVPSIVZDLHPURX-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.59
Rot. Bonds7

About 9-methyl-N-propan-2-yldec-7-yn-1-amine

9-methyl-N-propan-2-yldec-7-yn-1-amine (PubChem CID 170673540) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 9-methyl-N-propan-2-yldec-7-yn-1-amine.

Molecular Properties

Compound Name9-methyl-N-propan-2-yldec-7-yn-1-amine
PubChem CID170673540
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name9-methyl-N-propan-2-yldec-7-yn-1-amine
SMILESCC(C)C#CCCCCCCNC(C)C
InChIInChI=1S/C14H27N/c1-13(2)11-9-7-5-6-8-10-12-15-14(3)4/h13-15H,5-8,10,12H2,1-4H3
InChIKeyFVPSIVZDLHPURX-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-methylhept-4-yn-1-amine
CID 21391829
N-propan-2-ylicosan-1-amine
CID 87246132
8-hydrazinyl-N-propan-2-yloctan-1-amine
CID 167072309
N'-propan-2-yloctane-1,8-diamine
CID 138605826
N-propan-2-ylnonan-1-amine;hydrochloride
CID 172836169
6-methyl-N-propylhept-4-yn-1-amine;molecular hydrogen
CID 155740482
molecular hydrogen;N-propan-2-ylnonan-1-amine
CID 166461486
fluoromethane;N-propan-2-ylhexan-1-amine
CID 171626710
4-(propan-2-ylamino)butan-1-ol
CID 12950986
9-methyldec-7-yn-2-one
CID 133056852
13-methyl-N-propan-2-yltetradecan-1-amine;molecular hydrogen
CID 176932946
(2S,3S)-2,3-dihydroxy-N-(4-methylpent-2-ynyl)-4-oxo-7-(propan-2-ylamino)heptanamide
CID 157194967

Frequently Asked Questions

What is the IUPAC name of 9-methyl-N-propan-2-yldec-7-yn-1-amine?
The IUPAC name of 9-methyl-N-propan-2-yldec-7-yn-1-amine (CID 170673540) is 9-methyl-N-propan-2-yldec-7-yn-1-amine.
What is the SMILES notation for 9-methyl-N-propan-2-yldec-7-yn-1-amine?
The canonical SMILES for 9-methyl-N-propan-2-yldec-7-yn-1-amine is CC(C)C#CCCCCCCNC(C)C.
What is the InChIKey of 9-methyl-N-propan-2-yldec-7-yn-1-amine?
The InChIKey is FVPSIVZDLHPURX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-13(2)11-9-7-5-6-8-10-12-15-14(3)4/h13-15H,5-8,10,12H2,1-4H3.
What are the key properties of 9-methyl-N-propan-2-yldec-7-yn-1-amine?
9-methyl-N-propan-2-yldec-7-yn-1-amine has a molecular weight of 209.38 g/mol, XLogP of 3.59, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-N-propan-2-yldec-7-yn-1-amine is sourced from PubChem (CID 170673540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).