3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol

C11H22N2O — CID 106175334

IUPAC3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol
SMILESCCC(C)(CCO)NC1=NCCCC1
InChIInChI=1S/C11H22N2O/c1-3-11(2,7-9-14)13-10-6-4-5-8-12-10/h14H,3-9H2,1-2H3,(H,12,13)
InChIKeyRFUPCRYDJVJEAY-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.71
Rot. Bonds4

About 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol

3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol (PubChem CID 106175334) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol.

Molecular Properties

Compound Name3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol
PubChem CID106175334
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol
SMILESCCC(C)(CCO)NC1=NCCCC1
InChIInChI=1S/C11H22N2O/c1-3-11(2,7-9-14)13-10-6-4-5-8-12-10/h14H,3-9H2,1-2H3,(H,12,13)
InChIKeyRFUPCRYDJVJEAY-UHFFFAOYSA-N
XLogP1.71
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)butan-1-ol
CID 79503529
2-Methyl-2-(2,3,4,5-tetrahydropyridin-6-ylamino)butan-1-ol
CID 79503620
3-Methyl-4-(2,3,4,5-tetrahydropyridin-6-ylamino)butan-1-ol
CID 79504470
2-Methyl-2-(2,3,4,5-tetrahydropyridin-6-ylamino)propan-1-ol
CID 79507800
[1-(2,3,4,5-Tetrahydropyridin-6-ylamino)cyclopentyl]methanol
CID 79507842
2-(3,4-dihydro-2H-pyrrol-5-ylamino)-2-ethylbutan-1-ol
CID 79507948
2-ethyl-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)butan-1-ol
CID 79507949
2-Ethyl-2-(2,3,4,5-tetrahydropyridin-6-ylamino)butan-1-ol
CID 79508054
3-[(2,3,4,5-Tetrahydropyridin-6-ylamino)methyl]pentan-1-ol
CID 80289791
4-(2,3,4,5-Tetrahydropyridin-6-ylamino)pentan-1-ol
CID 80295206
2-Methyl-2-(2,3,4,5-tetrahydropyridin-6-ylamino)propane-1,3-diol
CID 81962792
3-(2,3,4,5-Tetrahydropyridin-6-ylamino)butan-1-ol
CID 83177293

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol?
The IUPAC name of 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol (CID 106175334) is 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol.
What is the SMILES notation for 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol?
The canonical SMILES for 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol is CCC(C)(CCO)NC1=NCCCC1.
What is the InChIKey of 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol?
The InChIKey is RFUPCRYDJVJEAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-11(2,7-9-14)13-10-6-4-5-8-12-10/h14H,3-9H2,1-2H3,(H,12,13).
What are the key properties of 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol?
3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol has a molecular weight of 198.31 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-(2,3,4,5-tetrahydropyridin-6-ylamino)pentan-1-ol is sourced from PubChem (CID 106175334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).