4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol

C14H28N2O — CID 106594618

IUPAC4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol
SMILESCC(CNC1CCC(O)CC1)CN1CCCC1
InChIInChI=1S/C14H28N2O/c1-12(11-16-8-2-3-9-16)10-15-13-4-6-14(17)7-5-13/h12-15,17H,2-11H2,1H3
InChIKeyYUYZIUZEZJEBSC-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.61
Rot. Bonds5

About 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol

4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol (PubChem CID 106594618) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol
PubChem CID106594618
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol
SMILESCC(CNC1CCC(O)CC1)CN1CCCC1
InChIInChI=1S/C14H28N2O/c1-12(11-16-8-2-3-9-16)10-15-13-4-6-14(17)7-5-13/h12-15,17H,2-11H2,1H3
InChIKeyYUYZIUZEZJEBSC-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol
CID 55141526
1-ethyl-N-(2-methyl-3-piperidin-1-ylpropyl)piperidin-4-amine
CID 54906375
1-[4-[(2-methyl-3-piperidin-1-ylpropyl)amino]piperidin-1-yl]ethanone
CID 60961230
3-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)cyclopentan-1-amine
CID 64502363
1-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)pyrrolidin-3-amine
CID 62975439
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 62992339
4-(2-methylpropylamino)cyclohexan-1-ol
CID 8024862
N-(2-methyl-3-morpholin-4-ylpropyl)cyclopentanamine
CID 115641946
N-(2-methyl-3-piperidin-1-ylpropyl)thiolan-3-amine
CID 61020549
3,3-dimethyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)cyclopentan-1-amine
CID 80705127
1,2-dimethyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)piperidin-4-amine
CID 81296513
1-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)pyrrolidin-3-amine
CID 62982179

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol (CID 106594618) is 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol is CC(CNC1CCC(O)CC1)CN1CCCC1.
What is the InChIKey of 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol?
The InChIKey is YUYZIUZEZJEBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12(11-16-8-2-3-9-16)10-15-13-4-6-14(17)7-5-13/h12-15,17H,2-11H2,1H3.
What are the key properties of 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol?
4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 106594618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).