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

C15H29N3O — CID 64792100

IUPAC2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol
SMILESOCC(CN1CCC(N2CCCCC2)C1)NC1CC1
InChIInChI=1S/C15H29N3O/c19-12-14(16-13-4-5-13)10-17-9-6-15(11-17)18-7-2-1-3-8-18/h13-16,19H,1-12H2
InChIKeyAUISUANMWVMZCU-UHFFFAOYSA-N
MW267.42 g/mol
LogP0.66
Rot. Bonds6

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

2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol (PubChem CID 64792100) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol
PubChem CID64792100
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol
SMILESOCC(CN1CCC(N2CCCCC2)C1)NC1CC1
InChIInChI=1S/C15H29N3O/c19-12-14(16-13-4-5-13)10-17-9-6-15(11-17)18-7-2-1-3-8-18/h13-16,19H,1-12H2
InChIKeyAUISUANMWVMZCU-UHFFFAOYSA-N
XLogP0.66
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol
CID 64791906
2-(cyclopropylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propanoic acid
CID 55159716
methyl 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propanoate
CID 63170968
2-(cyclopropylamino)-4-(3-morpholin-4-ylpyrrolidin-1-yl)butan-1-ol
CID 64791909
3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-(cyclopropylamino)propanoic acid
CID 79935240
2-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]propan-1-ol
CID 64795780
1-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
CID 63170952
1-cyclopentyl-N-methyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanamine
CID 104746172
2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butan-1-ol
CID 64826674
2-(cyclopropylamino)-3-morpholin-4-ylpropan-1-ol
CID 64798420
4-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)butan-1-ol
CID 64826874
1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine
CID 104746187

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol (CID 64792100) is 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol is OCC(CN1CCC(N2CCCCC2)C1)NC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol?
The InChIKey is AUISUANMWVMZCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c19-12-14(16-13-4-5-13)10-17-9-6-15(11-17)18-7-2-1-3-8-18/h13-16,19H,1-12H2.
What are the key properties of 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol?
2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol has a molecular weight of 267.42 g/mol, XLogP of 0.66, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol is sourced from PubChem (CID 64792100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).