1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine

C13H28N2O — CID 64605073

IUPAC1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(C(C)CCOC)CC1
InChIInChI=1S/C13H28N2O/c1-4-8-14-13-5-9-15(10-6-13)12(2)7-11-16-3/h12-14H,4-11H2,1-3H3
InChIKeyCDARYOKHKKYSAJ-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.88
Rot. Bonds7

About 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine

1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine (PubChem CID 64605073) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine
PubChem CID64605073
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(C(C)CCOC)CC1
InChIInChI=1S/C13H28N2O/c1-4-8-14-13-5-9-15(10-6-13)12(2)7-11-16-3/h12-14H,4-11H2,1-3H3
InChIKeyCDARYOKHKKYSAJ-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methoxybutan-2-yl)-N-propylpiperidin-3-amine
CID 64605758
1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine
CID 63925487
1-(1-methoxy-3-methylbutan-2-yl)-N-propylpiperidin-4-amine
CID 65049481
4-(1-chloroethyl)-1-(4-methoxybutan-2-yl)piperidine
CID 106838031
N-(3-methoxypropyl)-1-propan-2-ylpiperidin-4-amine
CID 28673243
N-ethyl-1-(4-methoxybutan-2-yl)piperidin-3-amine
CID 64605963
N-(6-methoxy-3,4-dimethylhexyl)cyclopropanamine
CID 116500457
1-hexan-3-yl-N-propylpyrrolidin-3-amine
CID 62119500
N-(3-methylhexyl)-1-propan-2-ylpiperidin-4-amine
CID 139366254
1-(4-methoxybutan-2-yl)-4-methylpiperidin-3-ol
CID 103898067
N-[4-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine
CID 56828316
1-(3-methylbutylsulfonyl)-N-propylpiperidin-4-amine
CID 63834582

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine?
The IUPAC name of 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine (CID 64605073) is 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine?
The canonical SMILES for 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine is CCCNC1CCN(C(C)CCOC)CC1.
What is the InChIKey of 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine?
The InChIKey is CDARYOKHKKYSAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-8-14-13-5-9-15(10-6-13)12(2)7-11-16-3/h12-14H,4-11H2,1-3H3.
What are the key properties of 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine?
1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine has a molecular weight of 228.38 g/mol, XLogP of 1.88, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxybutan-2-yl)-N-propylpiperidin-4-amine is sourced from PubChem (CID 64605073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).