6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol

C13H27NO — CID 163982710

IUPAC6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol
SMILESC=C(CO)C(C)(C)CC(C)(C)CNCC
InChIInChI=1S/C13H27NO/c1-7-14-10-12(3,4)9-13(5,6)11(2)8-15/h14-15H,2,7-10H2,1,3-6H3
InChIKeySZUKVUUBCTYMPV-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.59
Rot. Bonds7

About 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol

6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol (PubChem CID 163982710) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol.

Molecular Properties

Compound Name6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol
PubChem CID163982710
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol
SMILESC=C(CO)C(C)(C)CC(C)(C)CNCC
InChIInChI=1S/C13H27NO/c1-7-14-10-12(3,4)9-13(5,6)11(2)8-15/h14-15H,2,7-10H2,1,3-6H3
InChIKeySZUKVUUBCTYMPV-UHFFFAOYSA-N
XLogP2.59
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(Ethylamino)-4-methylidenehexan-1-ol
CID 88529932
[4-(2-Methylprop-2-enyl)piperidin-4-yl]methanol
CID 156796666
3-[(2-Methylidenebutylamino)methyl]hexan-1-ol
CID 106115164
3-[(3-Methylbut-3-enylamino)methyl]hexan-1-ol
CID 106115291
4,4-Dimethyl-5-(3-methylbut-3-enylamino)pentan-1-ol
CID 106147135
[1-[(3-Methylbut-3-enylamino)methyl]cyclopentyl]methanol
CID 114472457
[1-[(2-Methylidenebutylamino)methyl]cyclopentyl]methanol
CID 115359407
2-(Piperidin-4-ylmethyl)prop-2-en-1-ol
CID 117266657

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol?
The IUPAC name of 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol (CID 163982710) is 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol.
What is the SMILES notation for 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol?
The canonical SMILES for 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol is C=C(CO)C(C)(C)CC(C)(C)CNCC.
What is the InChIKey of 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol?
The InChIKey is SZUKVUUBCTYMPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-7-14-10-12(3,4)9-13(5,6)11(2)8-15/h14-15H,2,7-10H2,1,3-6H3.
What are the key properties of 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol?
6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol has a molecular weight of 213.36 g/mol, XLogP of 2.59, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-3,3,5,5-tetramethyl-2-methylidenehexan-1-ol is sourced from PubChem (CID 163982710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).