2-methyl-4-propylnonan-5-ol

C13H28O — CID 156689465

IUPAC2-methyl-4-propylnonan-5-ol
SMILESCCCCC(O)C(CCC)CC(C)C
InChIInChI=1S/C13H28O/c1-5-7-9-13(14)12(8-6-2)10-11(3)4/h11-14H,5-10H2,1-4H3
InChIKeyCVKKUQRCCTWTJI-UHFFFAOYSA-N
MW200.37 g/mol
LogP4.00
Rot. Bonds8

About 2-methyl-4-propylnonan-5-ol

2-methyl-4-propylnonan-5-ol (PubChem CID 156689465) has the molecular formula C13H28O and a molecular weight of 200.37 g/mol. Its IUPAC name is 2-methyl-4-propylnonan-5-ol.

Molecular Properties

Compound Name2-methyl-4-propylnonan-5-ol
PubChem CID156689465
Molecular FormulaC13H28O
Molecular Weight200.37 g/mol
Exact Mass200.21
IUPAC Name2-methyl-4-propylnonan-5-ol
SMILESCCCCC(O)C(CCC)CC(C)C
InChIInChI=1S/C13H28O/c1-5-7-9-13(14)12(8-6-2)10-11(3)4/h11-14H,5-10H2,1-4H3
InChIKeyCVKKUQRCCTWTJI-UHFFFAOYSA-N
XLogP4.00
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.37
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-butylnonan-4-ol
CID 173066814
2-methyl-4-(methylamino)nonan-5-ol
CID 58233630
7-ethyl-2-methylundecan-6-ol
CID 115829942
5-butylundecan-6-ol
CID 89253058
2-methyl-4-propan-2-ylheptane
CID 21201044
2,5-dimethyl-4-propyloctane
CID 57491236
2-butylhexane-1,3-diol
CID 18522832
2,4-dimethyl-6-propylnonan-5-ol
CID 156689504
4-(aminomethyl)undecan-5-ol
CID 79416345
4,8-dipropylundecane-5,7-diol
CID 157462430
(4S,5R)-4-amino-2-methyltetradecan-5-ol
CID 118735808
4-amino-2-methylundecan-5-ol
CID 72805371

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-propylnonan-5-ol?
The IUPAC name of 2-methyl-4-propylnonan-5-ol (CID 156689465) is 2-methyl-4-propylnonan-5-ol.
What is the SMILES notation for 2-methyl-4-propylnonan-5-ol?
The canonical SMILES for 2-methyl-4-propylnonan-5-ol is CCCCC(O)C(CCC)CC(C)C.
What is the InChIKey of 2-methyl-4-propylnonan-5-ol?
The InChIKey is CVKKUQRCCTWTJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O/c1-5-7-9-13(14)12(8-6-2)10-11(3)4/h11-14H,5-10H2,1-4H3.
What are the key properties of 2-methyl-4-propylnonan-5-ol?
2-methyl-4-propylnonan-5-ol has a molecular weight of 200.37 g/mol, XLogP of 4.00, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-propylnonan-5-ol is sourced from PubChem (CID 156689465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).