2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol

C14H29N3O — CID 64791906

IUPAC2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol
SMILESCCNC(CO)CN1CCC(N2CCCCC2)C1
InChIInChI=1S/C14H29N3O/c1-2-15-13(12-18)10-16-9-6-14(11-16)17-7-4-3-5-8-17/h13-15,18H,2-12H2,1H3
InChIKeyYPNSDZDVNPYHQK-UHFFFAOYSA-N
MW255.41 g/mol
LogP0.52
Rot. Bonds6

About 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol

2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol (PubChem CID 64791906) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol
PubChem CID64791906
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol
SMILESCCNC(CO)CN1CCC(N2CCCCC2)C1
InChIInChI=1S/C14H29N3O/c1-2-15-13(12-18)10-16-9-6-14(11-16)17-7-4-3-5-8-17/h13-15,18H,2-12H2,1H3
InChIKeyYPNSDZDVNPYHQK-UHFFFAOYSA-N
XLogP0.52
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-(ethylamino)butan-1-ol
CID 79924497
2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol
CID 64792100
1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine
CID 104746187
2-(ethylamino)-3-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)propan-1-ol
CID 79924571
2-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propanoic acid
CID 63165353
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-ethylpentan-2-amine
CID 79938837
2-(ethylamino)-4-(3-morpholin-4-ylpyrrolidin-1-yl)butan-1-ol
CID 64791294
1-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-ethyl-3-methoxypropan-2-amine
CID 107505868
1-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
CID 63170952
ethyl 2-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propanoate
CID 63165522
2-(ethylamino)-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-ol
CID 64791676
1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-ol
CID 55160321

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol?
The IUPAC name of 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol (CID 64791906) is 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol.
What is the SMILES notation for 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol?
The canonical SMILES for 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol is CCNC(CO)CN1CCC(N2CCCCC2)C1.
What is the InChIKey of 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol?
The InChIKey is YPNSDZDVNPYHQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-2-15-13(12-18)10-16-9-6-14(11-16)17-7-4-3-5-8-17/h13-15,18H,2-12H2,1H3.
What are the key properties of 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol?
2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol has a molecular weight of 255.41 g/mol, XLogP of 0.52, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol is sourced from PubChem (CID 64791906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).