2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol

C14H22N2O2 — CID 61374613

IUPAC2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol
SMILESCC(C)Oc1ncccc1CNC1CCCC1O
InChIInChI=1S/C14H22N2O2/c1-10(2)18-14-11(5-4-8-15-14)9-16-12-6-3-7-13(12)17/h4-5,8,10,12-13,16-17H,3,6-7,9H2,1-2H3
InChIKeyUPNQSHYWRMXUEN-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.87
Rot. Bonds5

About 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol

2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol (PubChem CID 61374613) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol
PubChem CID61374613
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol
SMILESCC(C)Oc1ncccc1CNC1CCCC1O
InChIInChI=1S/C14H22N2O2/c1-10(2)18-14-11(5-4-8-15-14)9-16-12-6-3-7-13(12)17/h4-5,8,10,12-13,16-17H,3,6-7,9H2,1-2H3
InChIKeyUPNQSHYWRMXUEN-UHFFFAOYSA-N
XLogP1.87
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopropanamine
CID 62290526
2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cycloheptane-1-carbonitrile
CID 62742241
4-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclohexan-1-amine
CID 61373850
4-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclohexane-1,4-diamine
CID 79741488
3-propan-2-yl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclobutan-1-amine
CID 103561785
2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopentan-1-amine
CID 79860528
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 61373670
3-chloro-2-[[(2-propan-2-yloxy-3-pyridinyl)methylamino]methyl]phenol
CID 78959442
N-[[2-(1-phenylethoxy)-3-pyridinyl]methyl]cyclopropanamine
CID 62291950
5-methyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]thiolan-3-amine
CID 79950310
trans-(1R,2R)-2-[(3-methyl-2-pyridinyl)methylamino]cyclopentan-1-ol
CID 102733463
2-[[[(1R,2R)-2-hydroxycyclopentyl]amino]methyl]phenol
CID 102734194

Frequently Asked Questions

What is the IUPAC name of 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol?
The IUPAC name of 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol (CID 61374613) is 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol.
What is the SMILES notation for 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol?
The canonical SMILES for 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol is CC(C)Oc1ncccc1CNC1CCCC1O.
What is the InChIKey of 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol?
The InChIKey is UPNQSHYWRMXUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10(2)18-14-11(5-4-8-15-14)9-16-12-6-3-7-13(12)17/h4-5,8,10,12-13,16-17H,3,6-7,9H2,1-2H3.
What are the key properties of 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol?
2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol has a molecular weight of 250.34 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]cyclopentan-1-ol is sourced from PubChem (CID 61374613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).