N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine

C16H33N3 — CID 64706614

IUPACN-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine
SMILESCCCNC(C)CC(C)N1CCC(N2CCCC2)C1
InChIInChI=1S/C16H33N3/c1-4-8-17-14(2)12-15(3)19-11-7-16(13-19)18-9-5-6-10-18/h14-17H,4-13H2,1-3H3
InChIKeyLJYJPJQTXDHUJJ-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.32
Rot. Bonds7

About N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine

N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine (PubChem CID 64706614) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine.

Molecular Properties

Compound NameN-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine
PubChem CID64706614
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC NameN-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine
SMILESCCCNC(C)CC(C)N1CCC(N2CCCC2)C1
InChIInChI=1S/C16H33N3/c1-4-8-17-14(2)12-15(3)19-11-7-16(13-19)18-9-5-6-10-18/h14-17H,4-13H2,1-3H3
InChIKeyLJYJPJQTXDHUJJ-UHFFFAOYSA-N
XLogP2.32
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-propylpentan-2-amine
CID 79932028
4-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-propylpentan-2-amine
CID 79931477
4-(3-tert-butylpyrrolidin-1-yl)-N-propylpentan-2-amine
CID 113417228
4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 64707229
N-propyl-4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]pentan-2-amine
CID 64706192
3-methyl-N-propyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butan-1-amine
CID 63167252
4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylpentan-2-amine
CID 66391124
N-[2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propyl]cyclopentanamine
CID 63167834
(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine
CID 130210207
4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide
CID 63584460
2-(3-morpholin-4-ylpyrrolidin-1-yl)-N-propylpropan-1-amine
CID 63167437
1-(1-propan-2-ylpyrrolidin-3-yl)piperidine
CID 58850224

Frequently Asked Questions

What is the IUPAC name of N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine?
The IUPAC name of N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine (CID 64706614) is N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine.
What is the SMILES notation for N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine?
The canonical SMILES for N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine is CCCNC(C)CC(C)N1CCC(N2CCCC2)C1.
What is the InChIKey of N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine?
The InChIKey is LJYJPJQTXDHUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-4-8-17-14(2)12-15(3)19-11-7-16(13-19)18-9-5-6-10-18/h14-17H,4-13H2,1-3H3.
What are the key properties of N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine?
N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine has a molecular weight of 267.46 g/mol, XLogP of 2.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine is sourced from PubChem (CID 64706614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).