5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine

C13H29N3O — CID 103391626

IUPAC5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine
SMILESCCCN1CCN(C(CCCN)COC)CC1
InChIInChI=1S/C13H29N3O/c1-3-7-15-8-10-16(11-9-15)13(12-17-2)5-4-6-14/h13H,3-12,14H2,1-2H3
InChIKeyCGARJKSRZXXHCZ-UHFFFAOYSA-N
MW243.39 g/mol
LogP0.77
Rot. Bonds8

About 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine

5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine (PubChem CID 103391626) has the molecular formula C13H29N3O and a molecular weight of 243.39 g/mol. Its IUPAC name is 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine.

Molecular Properties

Compound Name5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine
PubChem CID103391626
Molecular FormulaC13H29N3O
Molecular Weight243.39 g/mol
Exact Mass243.23
IUPAC Name5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine
SMILESCCCN1CCN(C(CCCN)COC)CC1
InChIInChI=1S/C13H29N3O/c1-3-7-15-8-10-16(11-9-15)13(12-17-2)5-4-6-14/h13H,3-12,14H2,1-2H3
InChIKeyCGARJKSRZXXHCZ-UHFFFAOYSA-N
XLogP0.77
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-4-piperidin-1-ylpentan-1-amine
CID 103391620
4-(4-propylpiperazin-1-yl)pentan-1-amine
CID 62423620
5-methoxy-4-(3,3,4-trimethylpiperazin-1-yl)pentan-1-amine
CID 103391911
1-(1,3-dimethoxypropan-2-yl)-4-ethylpiperazine
CID 142443734
4-(4-tert-butylazepan-1-yl)-5-methoxypentan-1-amine
CID 103391933
4-methoxy-4-methyl-2-(4-propylpiperazin-1-yl)pentan-1-amine
CID 106675511
4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine
CID 103392020
1-(2-methoxyethyl)-4-propyl-1,4-diazepane
CID 157028655
butyl 6-amino-3-pyrrolidin-1-ylhexanoate
CID 66819869
5-methoxy-4-(2-propan-2-ylpyrrolidin-1-yl)pentan-1-amine
CID 103391948
5-methoxy-4-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)pentan-1-amine
CID 103391890
2-methyl-3-(4-propylpiperazin-1-yl)butan-1-amine
CID 79414609

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine?
The IUPAC name of 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine (CID 103391626) is 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine.
What is the SMILES notation for 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine?
The canonical SMILES for 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine is CCCN1CCN(C(CCCN)COC)CC1.
What is the InChIKey of 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine?
The InChIKey is CGARJKSRZXXHCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O/c1-3-7-15-8-10-16(11-9-15)13(12-17-2)5-4-6-14/h13H,3-12,14H2,1-2H3.
What are the key properties of 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine?
5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine has a molecular weight of 243.39 g/mol, XLogP of 0.77, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine is sourced from PubChem (CID 103391626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).