2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol

C15H30N2O2 — CID 64791805

IUPAC2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol
SMILESCOCC1CCN(CCC(C)(CO)NC2CC2)CC1
InChIInChI=1S/C15H30N2O2/c1-15(12-18,16-14-3-4-14)7-10-17-8-5-13(6-9-17)11-19-2/h13-14,16,18H,3-12H2,1-2H3
InChIKeyMZTXWNWMGOGDRQ-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.24
Rot. Bonds8

About 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol

2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol (PubChem CID 64791805) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol
PubChem CID64791805
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol
SMILESCOCC1CCN(CCC(C)(CO)NC2CC2)CC1
InChIInChI=1S/C15H30N2O2/c1-15(12-18,16-14-3-4-14)7-10-17-8-5-13(6-9-17)11-19-2/h13-14,16,18H,3-12H2,1-2H3
InChIKeyMZTXWNWMGOGDRQ-UHFFFAOYSA-N
XLogP1.24
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-5-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylpentan-1-ol
CID 64809590
2-(cyclopropylamino)-4-(4-cyclopropylpiperazin-1-yl)-2-methylbutan-1-ol
CID 64826851
methyl 2-amino-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutanoate
CID 63971410
2-(ethylamino)-3-[4-(methoxymethyl)piperidin-1-yl]-2-methylpropan-1-ol
CID 64791191
2-(cyclopropylamino)-2-methyl-5-pyrrolidin-1-ylpentan-1-ol
CID 64798628
2-(cyclopropylamino)-4-(1,3-dihydroisoindol-2-yl)-2-methylbutan-1-ol
CID 64788187
4-(4-tert-butylpiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)butan-1-ol
CID 64787040
2-amino-6-[4-(methoxymethyl)piperidin-1-yl]-2-methylhexanoic acid
CID 63972004
N-(cyclopropylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine
CID 63978168
2-[(1-ethylpiperidin-4-yl)amino]-2-methylpentan-1-ol
CID 115920463
N-tert-butyl-4-[4-(methoxymethyl)piperidin-1-yl]butan-1-amine
CID 63977571
2-amino-4-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylbutanoic acid
CID 64581345

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol (CID 64791805) is 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol is COCC1CCN(CCC(C)(CO)NC2CC2)CC1.
What is the InChIKey of 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol?
The InChIKey is MZTXWNWMGOGDRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-15(12-18,16-14-3-4-14)7-10-17-8-5-13(6-9-17)11-19-2/h13-14,16,18H,3-12H2,1-2H3.
What are the key properties of 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol?
2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol has a molecular weight of 270.42 g/mol, XLogP of 1.24, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutan-1-ol is sourced from PubChem (CID 64791805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).