N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine

C14H29N3 — CID 107911214

IUPACN'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine
SMILESCN1CCCCC1CCN(CCCN)C1CC1
InChIInChI=1S/C14H29N3/c1-16-10-3-2-5-13(16)8-12-17(11-4-9-15)14-6-7-14/h13-14H,2-12,15H2,1H3
InChIKeyFGQNHKKBZJLLHE-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.67
Rot. Bonds7

About N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine

N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine (PubChem CID 107911214) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine
PubChem CID107911214
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine
SMILESCN1CCCCC1CCN(CCCN)C1CC1
InChIInChI=1S/C14H29N3/c1-16-10-3-2-5-13(16)8-12-17(11-4-9-15)14-6-7-14/h13-14H,2-12,15H2,1H3
InChIKeyFGQNHKKBZJLLHE-UHFFFAOYSA-N
XLogP1.67
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine
CID 62688458
2-[cyclopentyl-[2-(1-methylpiperidin-2-yl)ethyl]amino]acetonitrile
CID 103766604
2-[cyclopentyl-[2-(1-methylpiperidin-2-yl)ethyl]amino]acetic acid
CID 60834292
2-[(2S)-1-methylazepan-2-yl]ethanamine;molecular hydrogen
CID 178143502
N,N-dimethyl-3-(1-methylpiperidin-2-yl)propan-1-amine
CID 142889902
2-[cyclopropyl-[[(2R)-1-methylpiperidin-2-yl]methyl]amino]ethanol
CID 96553275
N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine
CID 114524959
4-(1-methylpiperidin-2-yl)butane-1-thiol;hydrobromide
CID 174870559
N'-cyclopentyl-N'-hexylpropane-1,3-diamine
CID 43137589
N'-cyclopentyl-N'-nonylpropane-1,3-diamine
CID 43319594
4-[(1-methylpiperidin-2-yl)methoxy]butan-1-amine
CID 65469045
2-methyl-2-N-[2-(1-methylpiperidin-2-yl)ethyl]-2-N-propylpropane-1,2-diamine
CID 107911289

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine?
The IUPAC name of N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine (CID 107911214) is N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine?
The canonical SMILES for N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine is CN1CCCCC1CCN(CCCN)C1CC1.
What is the InChIKey of N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine?
The InChIKey is FGQNHKKBZJLLHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-16-10-3-2-5-13(16)8-12-17(11-4-9-15)14-6-7-14/h13-14H,2-12,15H2,1H3.
What are the key properties of N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine?
N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine has a molecular weight of 239.41 g/mol, XLogP of 1.67, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine is sourced from PubChem (CID 107911214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).