1-[(1-propylpyrrolidin-2-yl)methyl]piperidine

C13H26N2 — CID 15626361

IUPAC1-[(1-propylpyrrolidin-2-yl)methyl]piperidine
SMILESCCCN1CCCC1CN1CCCCC1
InChIInChI=1S/C13H26N2/c1-2-8-15-11-6-7-13(15)12-14-9-4-3-5-10-14/h13H,2-12H2,1H3
InChIKeyNGVPNDMQUNDSTM-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.35
Rot. Bonds4

About 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine

1-[(1-propylpyrrolidin-2-yl)methyl]piperidine (PubChem CID 15626361) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine.

Molecular Properties

Compound Name1-[(1-propylpyrrolidin-2-yl)methyl]piperidine
PubChem CID15626361
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-[(1-propylpyrrolidin-2-yl)methyl]piperidine
SMILESCCCN1CCCC1CN1CCCCC1
InChIInChI=1S/C13H26N2/c1-2-8-15-11-6-7-13(15)12-14-9-4-3-5-10-14/h13H,2-12H2,1H3
InChIKeyNGVPNDMQUNDSTM-UHFFFAOYSA-N
XLogP2.35
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-1-propylpyrrolidine;hydrochloride
CID 175875106
(2S)-1-methyl-2-(pyrrolidin-1-ylmethyl)pyrrolidine
CID 10920923
4-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]butanoic acid
CID 119135261
N-[(1-propylpyrrolidin-2-yl)methyl]propan-2-amine
CID 62579817
N,N-diethyl-2-[(2S)-2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]acetamide
CID 95261573
N-[[(2R)-1-propylpiperidin-2-yl]methyl]propan-1-amine
CID 97017290
1-[[1-(oxolan-2-ylmethyl)pyrrolidin-2-yl]methyl]piperidine
CID 56824355
2-ethyl-5-methyl-1-propyl-azacycloundecane
CID 123350465
2-methyl-N-[(1-propylpiperidin-2-yl)methyl]propan-1-amine
CID 62580066
2-but-3-enyl-1-propylpyrrolidine
CID 155306373
3,5-dimethyl-1-[[(2R)-1-propylpyrrolidin-2-yl]methyl]pyrazole
CID 95341471
1-[[(2S)-1-propylpyrrolidin-2-yl]methyl]triazole-4-carbaldehyde
CID 129493606

Frequently Asked Questions

What is the IUPAC name of 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine?
The IUPAC name of 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine (CID 15626361) is 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine.
What is the SMILES notation for 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine?
The canonical SMILES for 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine is CCCN1CCCC1CN1CCCCC1.
What is the InChIKey of 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine?
The InChIKey is NGVPNDMQUNDSTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-8-15-11-6-7-13(15)12-14-9-4-3-5-10-14/h13H,2-12H2,1H3.
What are the key properties of 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine?
1-[(1-propylpyrrolidin-2-yl)methyl]piperidine has a molecular weight of 210.36 g/mol, XLogP of 2.35, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-propylpyrrolidin-2-yl)methyl]piperidine is sourced from PubChem (CID 15626361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).