N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine

C14H30N2 — CID 43749038

IUPACN-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine
SMILESCCCCCCNC(C)CN1CCCCC1
InChIInChI=1S/C14H30N2/c1-3-4-5-7-10-15-14(2)13-16-11-8-6-9-12-16/h14-15H,3-13H2,1-2H3
InChIKeyFWNZYWUCJZVYBE-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.03
Rot. Bonds8

About N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine

N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine (PubChem CID 43749038) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine.

Molecular Properties

Compound NameN-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine
PubChem CID43749038
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine
SMILESCCCCCCNC(C)CN1CCCCC1
InChIInChI=1S/C14H30N2/c1-3-4-5-7-10-15-14(2)13-16-11-8-6-9-12-16/h14-15H,3-13H2,1-2H3
InChIKeyFWNZYWUCJZVYBE-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.03
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

5-(1-pyrrolidin-1-ylpropan-2-ylamino)pentan-1-ol
CID 62228276
N-(2-methyl-3-piperidin-1-ylpropyl)octan-1-amine
CID 55191409
N-(3-methylsulfanylpropyl)-1-piperidin-1-ylpropan-2-amine
CID 43434982
5-(1-piperidin-1-ylpropan-2-ylamino)pentanamide
CID 114281596
N-(3-ethylsulfonylpropyl)-1-pyrrolidin-1-ylpropan-2-amine
CID 65093417
3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine
CID 43434983
N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675929
N',N'-dimethyl-N-(1-pyrrolidin-1-ylpropan-2-yl)propane-1,3-diamine
CID 114525110
N-butan-2-yldodecan-1-amine
CID 63489622
N-butan-2-ylundecan-1-amine
CID 151961423
N-[2-(azepan-1-yl)ethyl]heptan-2-amine
CID 61241150
N'-hydroxy-5-(1-piperidin-1-ylpropan-2-ylamino)pentanimidamide
CID 77030734

Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine?
The IUPAC name of N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine (CID 43749038) is N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine.
What is the SMILES notation for N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine?
The canonical SMILES for N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine is CCCCCCNC(C)CN1CCCCC1.
What is the InChIKey of N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine?
The InChIKey is FWNZYWUCJZVYBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-3-4-5-7-10-15-14(2)13-16-11-8-6-9-12-16/h14-15H,3-13H2,1-2H3.
What are the key properties of N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine?
N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine has a molecular weight of 226.41 g/mol, XLogP of 3.03, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine is sourced from PubChem (CID 43749038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).