4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol

C14H28N2O2 — CID 114210348

IUPAC4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol
SMILESCOCCC(CO)NC1CCCC1C1CCCN1
InChIInChI=1S/C14H28N2O2/c1-18-9-7-11(10-17)16-14-5-2-4-12(14)13-6-3-8-15-13/h11-17H,2-10H2,1H3
InChIKeyINEYDTAUGIKRHV-UHFFFAOYSA-N
MW256.39 g/mol
LogP0.89
Rot. Bonds7

About 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol

4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol (PubChem CID 114210348) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol.

Molecular Properties

Compound Name4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol
PubChem CID114210348
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol
SMILESCOCCC(CO)NC1CCCC1C1CCCN1
InChIInChI=1S/C14H28N2O2/c1-18-9-7-11(10-17)16-14-5-2-4-12(14)13-6-3-8-15-13/h11-17H,2-10H2,1H3
InChIKeyINEYDTAUGIKRHV-UHFFFAOYSA-N
XLogP0.89
TPSA53.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-pyrrolidin-2-ylcyclohexyl)amino]butan-1-ol
CID 79545851
3-[(2-piperidin-2-ylcyclopentyl)amino]pentan-1-ol
CID 113495583
1-methoxy-3-[(2-piperidin-2-ylcyclopentyl)amino]propan-2-ol
CID 79544808
(2S)-3-methyl-2-[(2-piperidin-2-ylcyclopentyl)amino]butan-1-ol
CID 79544884
N-hexan-3-yl-2-piperidin-2-ylcyclohexan-1-amine
CID 79553740
N-(2-methylpropoxy)-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 82711540
N-octan-4-yl-2-piperidin-2-ylcyclohexan-1-amine
CID 106023087
N-(4-methylpent-1-yn-3-yl)-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 114202020
2-methyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propan-1-ol
CID 79549663
4-methoxy-2-[[2-(trifluoromethyl)cyclohexyl]amino]butan-1-ol
CID 114210492
N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 79544436
N-(2-propan-2-yloxyethyl)-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 104759328

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol?
The IUPAC name of 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol (CID 114210348) is 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol.
What is the SMILES notation for 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol?
The canonical SMILES for 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol is COCCC(CO)NC1CCCC1C1CCCN1.
What is the InChIKey of 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol?
The InChIKey is INEYDTAUGIKRHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-18-9-7-11(10-17)16-14-5-2-4-12(14)13-6-3-8-15-13/h11-17H,2-10H2,1H3.
What are the key properties of 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol?
4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol has a molecular weight of 256.39 g/mol, XLogP of 0.89, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol is sourced from PubChem (CID 114210348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).