N-(3-butoxypropyl)piperidin-4-amine

C12H26N2O — CID 20735437

IUPACN-(3-butoxypropyl)piperidin-4-amine
SMILESCCCCOCCCNC1CCNCC1
InChIInChI=1S/C12H26N2O/c1-2-3-10-15-11-4-7-14-12-5-8-13-9-6-12/h12-14H,2-11H2,1H3
InChIKeyPZNRSYXPYAOMMQ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.53
Rot. Bonds8

About N-(3-butoxypropyl)piperidin-4-amine

N-(3-butoxypropyl)piperidin-4-amine (PubChem CID 20735437) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-(3-butoxypropyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(3-butoxypropyl)piperidin-4-amine
PubChem CID20735437
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-(3-butoxypropyl)piperidin-4-amine
SMILESCCCCOCCCNC1CCNCC1
InChIInChI=1S/C12H26N2O/c1-2-3-10-15-11-4-7-14-12-5-8-13-9-6-12/h12-14H,2-11H2,1H3
InChIKeyPZNRSYXPYAOMMQ-UHFFFAOYSA-N
XLogP1.53
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-butoxypropyl)cyclopropanamine
CID 62450977
N-[3-(2-methoxyethoxy)propyl]piperidin-4-amine
CID 61016689
N-(5-ethoxypentyl)piperidin-4-amine
CID 164907072
4-(3-butoxypropylamino)cyclohexan-1-ol
CID 106595163
(3S)-N-butylpyrrolidin-3-amine
CID 154470800
N-(3-octoxypropyl)cyclohexanamine
CID 63506430
N-(3-butoxypropyl)spiro[4.5]decan-8-amine
CID 114817917
N-(3-propoxypropyl)piperidin-3-amine
CID 82939747
N-[3-(2-ethoxyethoxy)propyl]cyclopropanamine
CID 62445452
N-[4-(2-propoxyethoxy)butyl]cyclopropanamine
CID 63686428
N-(6,6-dimethylheptyl)piperidin-4-amine
CID 170373818
1-butyl-2-piperidin-4-ylhydrazine
CID 174712334

Frequently Asked Questions

What is the IUPAC name of N-(3-butoxypropyl)piperidin-4-amine?
The IUPAC name of N-(3-butoxypropyl)piperidin-4-amine (CID 20735437) is N-(3-butoxypropyl)piperidin-4-amine.
What is the SMILES notation for N-(3-butoxypropyl)piperidin-4-amine?
The canonical SMILES for N-(3-butoxypropyl)piperidin-4-amine is CCCCOCCCNC1CCNCC1.
What is the InChIKey of N-(3-butoxypropyl)piperidin-4-amine?
The InChIKey is PZNRSYXPYAOMMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-2-3-10-15-11-4-7-14-12-5-8-13-9-6-12/h12-14H,2-11H2,1H3.
What are the key properties of N-(3-butoxypropyl)piperidin-4-amine?
N-(3-butoxypropyl)piperidin-4-amine has a molecular weight of 214.35 g/mol, XLogP of 1.53, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-butoxypropyl)piperidin-4-amine is sourced from PubChem (CID 20735437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).