N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine

C13H26N2 — CID 60868216

IUPACN-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine
SMILESCC1CCCC(C)N1CCCNC1CC1
InChIInChI=1S/C13H26N2/c1-11-5-3-6-12(2)15(11)10-4-9-14-13-7-8-13/h11-14H,3-10H2,1-2H3
InChIKeyXBYIFMKFUHTDTK-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.39
Rot. Bonds5

About N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine

N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine (PubChem CID 60868216) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine
PubChem CID60868216
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine
SMILESCC1CCCC(C)N1CCCNC1CC1
InChIInChI=1S/C13H26N2/c1-11-5-3-6-12(2)15(11)10-4-9-14-13-7-8-13/h11-14H,3-10H2,1-2H3
InChIKeyXBYIFMKFUHTDTK-UHFFFAOYSA-N
XLogP2.39
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2,6-dimethylpiperidin-1-yl)-N-methylpropan-1-amine
CID 61386862
N-[6-(2-ethyl-5-methylpyrrolidin-1-yl)hexyl]cyclopropanamine
CID 83221067
3-[(2R,6S)-2,6-dimethylpiperidin-1-yl]propan-1-amine
CID 7176132
1-hexyl-2,6-dimethylpiperidine
CID 6428887
4-(2,6-dimethylpiperidin-1-yl)butan-1-ol
CID 19867661
N-[3-(2-methylpiperidin-1-yl)propyl]cyclohexanamine
CID 43178283
N-[3-(2-methylpiperidin-1-yl)propyl]-4-propan-2-ylcycloheptan-1-amine
CID 65087209
4-ethyl-N-[3-(2-methylpiperidin-1-yl)propyl]cyclohexan-1-amine
CID 43079554
N-[4-(3,4,5-trimethylpiperazin-1-yl)butyl]cyclopropanamine
CID 114540197
2,6-dimethyl-1-pent-4-ynylpiperidine
CID 115873069
N,N'-dicyclopropyloctane-1,8-diamine
CID 66337537
2-(2,6-dimethylpiperidin-1-yl)ethanethiol
CID 19607260

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine?
The IUPAC name of N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine (CID 60868216) is N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine.
What is the SMILES notation for N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine?
The canonical SMILES for N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine is CC1CCCC(C)N1CCCNC1CC1.
What is the InChIKey of N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine?
The InChIKey is XBYIFMKFUHTDTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-11-5-3-6-12(2)15(11)10-4-9-14-13-7-8-13/h11-14H,3-10H2,1-2H3.
What are the key properties of N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine?
N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine has a molecular weight of 210.36 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,6-dimethylpiperidin-1-yl)propyl]cyclopropanamine is sourced from PubChem (CID 60868216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).